Organoheterocyclic compounds
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(-)-1,2-Bis((2R,5R)-2,5-diphenylphospholano)ethane, 95%
CAS: 528565-79-9 Molecular Formula: C34H36P2 Molecular Weight (g/mol): 506.61 MDL Number: MFCD07369027 InChI Key: VHHAZLMVLLIMHT-DXCZPEQUNA-N Synonym: --1,2-bis 2r,5r-2,5-diphenylphospholano ethane,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane,,1,2-bis 2r,5r-2,5-diphenylphospholan-1-yl ethane,1,1'-ethylenebis 2beta,5alpha-diphenyltetrahydro-1h-phosphole,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane, kanata purity,2r,5r-1-2-2r,5r-2,5-diphenylphospholan-1-yl ethyl-2,5-diphenylphospholane PubChem CID: 11420783 SMILES: C(CP1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1)P1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 11420783 |
|---|---|
| CAS | 528565-79-9 |
| Molecular Weight (g/mol) | 506.61 |
| MDL Number | MFCD07369027 |
| SMILES | C(CP1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1)P1[C@H](CC[C@@H]1C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | --1,2-bis 2r,5r-2,5-diphenylphospholano ethane,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane,,1,2-bis 2r,5r-2,5-diphenylphospholan-1-yl ethane,1,1'-ethylenebis 2beta,5alpha-diphenyltetrahydro-1h-phosphole,--1,2-bis 2r,5r-2,5-diphenylphospholano ethane, kanata purity,2r,5r-1-2-2r,5r-2,5-diphenylphospholan-1-yl ethyl-2,5-diphenylphospholane |
| InChI Key | VHHAZLMVLLIMHT-DXCZPEQUNA-N |
| Molecular Formula | C34H36P2 |
(2S,5S)-1-(2-(1,3-Dioxolan-2-yl)phenyl)-2,5-diethylphospholane, 97%, Thermo Scientific™
CAS: 1314246-02-0 Molecular Formula: C17H25O2P Molecular Weight (g/mol): 292.36 MDL Number: MFCD09265099 InChI Key: UKBFKBMQNUOKTD-UHFFFAOYNA-N Synonym: 2s,5s---1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane,s,s-et-rajphos,2-2-2s,5s-2,5-diethyl-1-phospholano phenyl 1,3-dioxolane,2-2-2s,5s-2,5-diethylphospholan-1-yl phenyl-1,3-dioxolane,trans-1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane,2s,5s-1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane,2s,5s---1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane, kanata purity PubChem CID: 16218309 IUPAC Name: 1-[2-(1,3-dioxolan-2-yl)phenyl]-2,5-diethylphospholane SMILES: CCC1CCC(CC)P1C1=CC=CC=C1C1OCCO1
| PubChem CID | 16218309 |
|---|---|
| CAS | 1314246-02-0 |
| Molecular Weight (g/mol) | 292.36 |
| MDL Number | MFCD09265099 |
| SMILES | CCC1CCC(CC)P1C1=CC=CC=C1C1OCCO1 |
| Synonym | 2s,5s---1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane,s,s-et-rajphos,2-2-2s,5s-2,5-diethyl-1-phospholano phenyl 1,3-dioxolane,2-2-2s,5s-2,5-diethylphospholan-1-yl phenyl-1,3-dioxolane,trans-1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane,2s,5s-1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane,2s,5s---1-2-1,3-dioxolan-2-yl phenyl-2,5-diethylphospholane, kanata purity |
| IUPAC Name | 1-[2-(1,3-dioxolan-2-yl)phenyl]-2,5-diethylphospholane |
| InChI Key | UKBFKBMQNUOKTD-UHFFFAOYNA-N |
| Molecular Formula | C17H25O2P |
(2S,5S)-1-(2-(1,3-Dioxolan-2-yl)phenyl)-2,5-dimethylphospholane, 97%, Thermo Scientific™
CAS: 695816-47-8 Molecular Formula: C15H21O2P Molecular Weight (g/mol): 264.3 InChI Key: JAKXTLMNIHPLEU-RYUDHWBXSA-N Synonym: 2s,5s-+-1-2-1,3-dioxolan-2-yl phenyl-2,5-dimethylphospholane,2s,5s-1-2-1,3-dioxolan-2-yl phenyl-2,5-dimethylphospholane,s,s-me-rajphos,2-2-2s,5s-2,5-dimethylphospholan-1-yl phenyl-1,3-dioxolane,2s,5s-+-1-2-1,3-dioxolan-2-yl phenyl-2,5-dimethylphospholane, kanata purity,1-2-1,3-dioxolane-2-yl phenyl-2beta,5alpha-dimethyltetrahydro-1h-phosphole,2-2-2s,5s-2,5-dimethyl-1-phospholano phenyl 1,3-dioxolane, min PubChem CID: 16218307 IUPAC Name: 2-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-1,3-dioxolane SMILES: CC1CCC(P1C2=CC=CC=C2C3OCCO3)C
| PubChem CID | 16218307 |
|---|---|
| CAS | 695816-47-8 |
| Molecular Weight (g/mol) | 264.3 |
| SMILES | CC1CCC(P1C2=CC=CC=C2C3OCCO3)C |
| Synonym | 2s,5s-+-1-2-1,3-dioxolan-2-yl phenyl-2,5-dimethylphospholane,2s,5s-1-2-1,3-dioxolan-2-yl phenyl-2,5-dimethylphospholane,s,s-me-rajphos,2-2-2s,5s-2,5-dimethylphospholan-1-yl phenyl-1,3-dioxolane,2s,5s-+-1-2-1,3-dioxolan-2-yl phenyl-2,5-dimethylphospholane, kanata purity,1-2-1,3-dioxolane-2-yl phenyl-2beta,5alpha-dimethyltetrahydro-1h-phosphole,2-2-2s,5s-2,5-dimethyl-1-phospholano phenyl 1,3-dioxolane, min |
| IUPAC Name | 2-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-1,3-dioxolane |
| InChI Key | JAKXTLMNIHPLEU-RYUDHWBXSA-N |
| Molecular Formula | C15H21O2P |
1,2-Bis[(2S,5S)-2,5-dimethyl-1-phospholanyl]benzene, 97+%
CAS: 136735-95-0 Molecular Formula: C18H28P2 Molecular Weight (g/mol): 306.37 MDL Number: MFCD00142322 InChI Key: AJNZWRKTWQLAJK-VGWMRTNUSA-N Synonym: s,s-me-duphos,methyl-duphos, s,s,s,s-methyl-duphos,unii-hl745j99sb,+-1,2-bis 2s,5s-2,5-dimethylphospholano benzene,phospholane, 1,1'-1,2-phenylene bis 2,5-dimethyl-, 2s,2's,5s,5's,s,s-me-duphos mi,s,s-methyl-duphos, +,2s,5s-1-2-2s,5s-2,5-dimethylphospholan-1-yl phenyl-2,5-dimethylphospholane PubChem CID: 2734553 IUPAC Name: (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane SMILES: CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C
| PubChem CID | 2734553 |
|---|---|
| CAS | 136735-95-0 |
| Molecular Weight (g/mol) | 306.37 |
| MDL Number | MFCD00142322 |
| SMILES | CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C |
| Synonym | s,s-me-duphos,methyl-duphos, s,s,s,s-methyl-duphos,unii-hl745j99sb,+-1,2-bis 2s,5s-2,5-dimethylphospholano benzene,phospholane, 1,1'-1,2-phenylene bis 2,5-dimethyl-, 2s,2's,5s,5's,s,s-me-duphos mi,s,s-methyl-duphos, +,2s,5s-1-2-2s,5s-2,5-dimethylphospholan-1-yl phenyl-2,5-dimethylphospholane |
| IUPAC Name | (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane |
| InChI Key | AJNZWRKTWQLAJK-VGWMRTNUSA-N |
| Molecular Formula | C18H28P2 |
Naloxone hydrochloride, 98%
CAS: 357-08-4 Molecular Formula: C19H22ClNO4 Molecular Weight (g/mol): 363.838 MDL Number: MFCD00069322 InChI Key: RGPDIGOSVORSAK-STHHAXOLSA-N Synonym: naloxone hydrochloride,naloxone hcl,narcan,evzio,unii-f850569pqr,nalonee,17-allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride,narcan tn,naloxonehydrochloride PubChem CID: 5464092 IUPAC Name: (4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C=CCN1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O.Cl
| PubChem CID | 5464092 |
|---|---|
| CAS | 357-08-4 |
| Molecular Weight (g/mol) | 363.838 |
| MDL Number | MFCD00069322 |
| SMILES | C=CCN1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O.Cl |
| Synonym | naloxone hydrochloride,naloxone hcl,narcan,evzio,unii-f850569pqr,nalonee,17-allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride,narcan tn,naloxonehydrochloride |
| IUPAC Name | (4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride |
| InChI Key | RGPDIGOSVORSAK-STHHAXOLSA-N |
| Molecular Formula | C19H22ClNO4 |
3-Amino-1,2,4-triazole, 96.1%, MP Biomedicals™
CAS: 61-82-5 Molecular Formula: C2H4N4 Molecular Weight (g/mol): 84.08 MDL Number: MFCD00005230,MFCD00053362 InChI Key: KLSJWNVTNUYHDU-UHFFFAOYSA-N Synonym: 3-amino-1,2,4-triazole,amitrole,aminotriazole,4h-1,2,4-triazol-3-amine,1h-1,2,4-triazol-3-amine,amitrol,amerol,amizol,emisol,vorox PubChem CID: 1639 ChEBI: CHEBI:40036 IUPAC Name: 1H-1,2,4-triazol-5-amine SMILES: NC1=NC=NN1
| PubChem CID | 1639 |
|---|---|
| CAS | 61-82-5 |
| Molecular Weight (g/mol) | 84.08 |
| ChEBI | CHEBI:40036 |
| MDL Number | MFCD00005230,MFCD00053362 |
| SMILES | NC1=NC=NN1 |
| Synonym | 3-amino-1,2,4-triazole,amitrole,aminotriazole,4h-1,2,4-triazol-3-amine,1h-1,2,4-triazol-3-amine,amitrol,amerol,amizol,emisol,vorox |
| IUPAC Name | 1H-1,2,4-triazol-5-amine |
| InChI Key | KLSJWNVTNUYHDU-UHFFFAOYSA-N |
| Molecular Formula | C2H4N4 |
Astemizole, 99+%
CAS: 68844-77-9 Molecular Formula: C28H31FN4O Molecular Weight (g/mol): 458.581 MDL Number: MFCD00153919 InChI Key: GXDALQBWZGODGZ-UHFFFAOYSA-N Synonym: astemizole,hismanal,histaminos,paralergin,laridal,retolen,alermizol,astemison,astemizol,histamen PubChem CID: 2247 ChEBI: CHEBI:2896 IUPAC Name: 1-[(4-fluorophenyl)methyl]-N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]benzimidazol-2-amine SMILES: COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F
| PubChem CID | 2247 |
|---|---|
| CAS | 68844-77-9 |
| Molecular Weight (g/mol) | 458.581 |
| ChEBI | CHEBI:2896 |
| MDL Number | MFCD00153919 |
| SMILES | COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F |
| Synonym | astemizole,hismanal,histaminos,paralergin,laridal,retolen,alermizol,astemison,astemizol,histamen |
| IUPAC Name | 1-[(4-fluorophenyl)methyl]-N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]benzimidazol-2-amine |
| InChI Key | GXDALQBWZGODGZ-UHFFFAOYSA-N |
| Molecular Formula | C28H31FN4O |
Naltrexone hydrochloride, Thermo Scientific Chemicals
CAS: 16676-29-2 Molecular Formula: C20H24ClNO4 Molecular Weight (g/mol): 377.865 MDL Number: MFCD00069324 InChI Key: RHBRMCOKKKZVRY-ITLPAZOVSA-N Synonym: naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin PubChem CID: 5485201 IUPAC Name: (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl
| PubChem CID | 5485201 |
|---|---|
| CAS | 16676-29-2 |
| Molecular Weight (g/mol) | 377.865 |
| MDL Number | MFCD00069324 |
| SMILES | C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl |
| Synonym | naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin |
| IUPAC Name | (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride |
| InChI Key | RHBRMCOKKKZVRY-ITLPAZOVSA-N |
| Molecular Formula | C20H24ClNO4 |
2-Mercaptopyridine N-oxide sodium salt, anhydrous, 98%
CAS: 3811-73-2 Molecular Formula: C5H4NNaOS Molecular Weight (g/mol): 149.143 MDL Number: MFCD01941547 InChI Key: XNRNJIIJLOFJEK-UHFFFAOYSA-N Synonym: sodium omadine,sodium pyrithione,sodium 2-pyridylthio-n-oxide,pyrithione sodium salt,thione reagent,2-pyridinethiol-1-oxide sodium salt,2-mercaptopyridine n-oxide sodium salt,omadine sodium,sodium-2-pyridinethiol-1-oxide,sodium omadine van PubChem CID: 19658 IUPAC Name: sodium;1-oxidopyridine-2-thione SMILES: C1=CC(=S)N(C=C1)[O-].[Na+]
| PubChem CID | 19658 |
|---|---|
| CAS | 3811-73-2 |
| Molecular Weight (g/mol) | 149.143 |
| MDL Number | MFCD01941547 |
| SMILES | C1=CC(=S)N(C=C1)[O-].[Na+] |
| Synonym | sodium omadine,sodium pyrithione,sodium 2-pyridylthio-n-oxide,pyrithione sodium salt,thione reagent,2-pyridinethiol-1-oxide sodium salt,2-mercaptopyridine n-oxide sodium salt,omadine sodium,sodium-2-pyridinethiol-1-oxide,sodium omadine van |
| IUPAC Name | sodium;1-oxidopyridine-2-thione |
| InChI Key | XNRNJIIJLOFJEK-UHFFFAOYSA-N |
| Molecular Formula | C5H4NNaOS |
1-n-Butyl-3-methylimidazolium bromide, 99%
CAS: 85100-77-2 Molecular Formula: C8H15BrN2 Molecular Weight (g/mol): 219.126 MDL Number: MFCD03427611 InChI Key: KYCQOKLOSUBEJK-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium bromide,3-butyl-1-methyl-1h-imidazol-3-ium bromide,bmimbr,1-n-butyl-3-methylimidazolium bromide,1-butyl-3-methyl-1h-imidazol-3-ium bromide,bmim br,c4mim bromide,ksc491c7d,1-butyl-3-methylimidazoliumbromide PubChem CID: 2734236 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;bromide SMILES: CCCCN1C=C[N+](=C1)C.[Br-]
| PubChem CID | 2734236 |
|---|---|
| CAS | 85100-77-2 |
| Molecular Weight (g/mol) | 219.126 |
| MDL Number | MFCD03427611 |
| SMILES | CCCCN1C=C[N+](=C1)C.[Br-] |
| Synonym | 1-butyl-3-methylimidazolium bromide,3-butyl-1-methyl-1h-imidazol-3-ium bromide,bmimbr,1-n-butyl-3-methylimidazolium bromide,1-butyl-3-methyl-1h-imidazol-3-ium bromide,bmim br,c4mim bromide,ksc491c7d,1-butyl-3-methylimidazoliumbromide |
| IUPAC Name | 1-butyl-3-methylimidazol-3-ium;bromide |
| InChI Key | KYCQOKLOSUBEJK-UHFFFAOYSA-M |
| Molecular Formula | C8H15BrN2 |
N,N,N',N'-Tetramethyl-O-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)uronium tetrafluoroborate, 98+%, Thermo Scientific Chemicals
CAS: 125700-69-8 Molecular Formula: C12H16BF4N5O2 Molecular Weight (g/mol): 349.10 MDL Number: MFCD00077730 InChI Key: FOBCPCIJLQTYBT-UHFFFAOYSA-N Synonym: tdbtu,n,n,n',n'-tetramethyl-o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl uronium tetrafluoroborate,o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl-n,n,n',n'-tetramethyluronium tetrafluoroborate,1,1,3,3-tetramethyl-2-4-oxobenzo d 1,2,3 triazin-3 4h-yl uronium tetrafluoroborate,o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl-n,n,n',n'-tetramethyluroniumtetrafluoroborate,tdbtu; n,n,n',n'-tetramethyl-o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl uronium tetrafluoroborate,dimethylamino 4-oxo-1,2,3-benzotriazin-3-yl oxy methylidene dimethylazanium tetrafluoroborate,pubchem12760,acmc-1cac0,d04fkx PubChem CID: 10882602 IUPAC Name: [dimethylamino-[(4-oxo-1,2,3-benzotriazin-3-yl)oxy]methylidene]-dimethylazanium;tetrafluoroborate SMILES: F[B-](F)(F)F.CN(C)C(ON1N=NC2=CC=CC=C2C1=O)=[N+](C)C
| PubChem CID | 10882602 |
|---|---|
| CAS | 125700-69-8 |
| Molecular Weight (g/mol) | 349.10 |
| MDL Number | MFCD00077730 |
| SMILES | F[B-](F)(F)F.CN(C)C(ON1N=NC2=CC=CC=C2C1=O)=[N+](C)C |
| Synonym | tdbtu,n,n,n',n'-tetramethyl-o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl uronium tetrafluoroborate,o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl-n,n,n',n'-tetramethyluronium tetrafluoroborate,1,1,3,3-tetramethyl-2-4-oxobenzo d 1,2,3 triazin-3 4h-yl uronium tetrafluoroborate,o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl-n,n,n',n'-tetramethyluroniumtetrafluoroborate,tdbtu; n,n,n',n'-tetramethyl-o-3,4-dihydro-4-oxo-1,2,3-benzotriazin-3-yl uronium tetrafluoroborate,dimethylamino 4-oxo-1,2,3-benzotriazin-3-yl oxy methylidene dimethylazanium tetrafluoroborate,pubchem12760,acmc-1cac0,d04fkx |
| IUPAC Name | [dimethylamino-[(4-oxo-1,2,3-benzotriazin-3-yl)oxy]methylidene]-dimethylazanium;tetrafluoroborate |
| InChI Key | FOBCPCIJLQTYBT-UHFFFAOYSA-N |
| Molecular Formula | C12H16BF4N5O2 |
1,10-Phenanthroline-5,6-dione, 98%
CAS: 27318-90-7 Molecular Formula: C12H6N2O2 Molecular Weight (g/mol): 210.19 MDL Number: MFCD00014473 InChI Key: KCALAFIVPCAXJI-UHFFFAOYSA-N Synonym: 1,10 phenanthroline-5,6-dione,1 10-phenanthroline-5 6-dione 97,pyridino 3,2-h quinoline-5,6-dione,phen-5,6-dione,pubchem16755,acmc-209gwd,d0jh7c,phox31,ksc204s8l,1,2-dione-based compound, 17 PubChem CID: 72810 IUPAC Name: 1,10-phenanthroline-5,6-dione SMILES: O=C1C(=O)C2=CC=CN=C2C2=NC=CC=C12
| PubChem CID | 72810 |
|---|---|
| CAS | 27318-90-7 |
| Molecular Weight (g/mol) | 210.19 |
| MDL Number | MFCD00014473 |
| SMILES | O=C1C(=O)C2=CC=CN=C2C2=NC=CC=C12 |
| Synonym | 1,10 phenanthroline-5,6-dione,1 10-phenanthroline-5 6-dione 97,pyridino 3,2-h quinoline-5,6-dione,phen-5,6-dione,pubchem16755,acmc-209gwd,d0jh7c,phox31,ksc204s8l,1,2-dione-based compound, 17 |
| IUPAC Name | 1,10-phenanthroline-5,6-dione |
| InChI Key | KCALAFIVPCAXJI-UHFFFAOYSA-N |
| Molecular Formula | C12H6N2O2 |
Metronidazole, 99%
CAS: 443-48-1 Molecular Formula: C6H9N3O3 Molecular Weight (g/mol): 171.156 MDL Number: MFCD00009750 InChI Key: VAOCPAMSLUNLGC-UHFFFAOYSA-N Synonym: metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol PubChem CID: 4173 ChEBI: CHEBI:6909 IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanol SMILES: CC1=NC=C(N1CCO)[N+](=O)[O-]
| PubChem CID | 4173 |
|---|---|
| CAS | 443-48-1 |
| Molecular Weight (g/mol) | 171.156 |
| ChEBI | CHEBI:6909 |
| MDL Number | MFCD00009750 |
| SMILES | CC1=NC=C(N1CCO)[N+](=O)[O-] |
| Synonym | metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol |
| IUPAC Name | 2-(2-methyl-5-nitroimidazol-1-yl)ethanol |
| InChI Key | VAOCPAMSLUNLGC-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3O3 |
Thermo Scientific Chemicals Cefadroxil, 95-105%
CAS: 66592-87-8 Molecular Formula: C16H17N3O5S Molecular Weight (g/mol): 363.39 InChI Key: BOEGTKLJZSQCCD-UEKVPHQBSA-N Synonym: cefadroxil,cephadroxil,cefadroxil anhydrous,cefadroxilo,cefadroxilum,d-cefadroxil,duricef,ultracef,cefadroxilum inn-latin,unii-q525pa8jjb PubChem CID: 47965 ChEBI: CHEBI:3479 IUPAC Name: (6R,7R)-7-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid SMILES: CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O
| PubChem CID | 47965 |
|---|---|
| CAS | 66592-87-8 |
| Molecular Weight (g/mol) | 363.39 |
| ChEBI | CHEBI:3479 |
| SMILES | CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O |
| Synonym | cefadroxil,cephadroxil,cefadroxil anhydrous,cefadroxilo,cefadroxilum,d-cefadroxil,duricef,ultracef,cefadroxilum inn-latin,unii-q525pa8jjb |
| IUPAC Name | (6R,7R)-7-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| InChI Key | BOEGTKLJZSQCCD-UEKVPHQBSA-N |
| Molecular Formula | C16H17N3O5S |
Ceftizoxime, Thermo Scientific Chemicals
CAS: 68401-81-0 Molecular Formula: C13H13N5O5S2 Molecular Weight (g/mol): 383.40 MDL Number: MFCD00072000 InChI Key: NNULBSISHYWZJU-LLKWHZGFSA-N IUPAC Name: sodium (6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-5-yl)-2-(methoxyimino)acetamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate SMILES: [H][C@]12SCC=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\C1=CSC(N)=N1)C(O)=O
| CAS | 68401-81-0 |
|---|---|
| Molecular Weight (g/mol) | 383.40 |
| MDL Number | MFCD00072000 |
| SMILES | [H][C@]12SCC=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\C1=CSC(N)=N1)C(O)=O |
| IUPAC Name | sodium (6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-5-yl)-2-(methoxyimino)acetamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
| InChI Key | NNULBSISHYWZJU-LLKWHZGFSA-N |
| Molecular Formula | C13H13N5O5S2 |