Organoheterocyclic compounds
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3-(1-Pyridinio)-1-propanesulfonate, 99%
CAS: 15471-17-7 Molecular Formula: C8H11NO3S Molecular Weight (g/mol): 201.24 MDL Number: MFCD00064468 InChI Key: REEBJQTUIJTGAL-UHFFFAOYSA-N Synonym: 3-pyridin-1-ium-1-yl propane-1-sulfonate,ndsb-201,1-3-sulphonatopropyl pyridinium,unii-qn4i6ai9ek,3-1-pyridinio-1-propanesulfonate,1-pyridiniumpropane-3-sulfonate,qn4i6ai9ek,1-3-sulfopropyl pyridinium hydroxide, inner salt,pyridinium, 1-3-sulfopropyl-, inner salt,1-3-sulfonatopropyl pyridin-1-ium PubChem CID: 84929 IUPAC Name: 3-pyridin-1-ium-1-ylpropane-1-sulfonate SMILES: [O-]S(=O)(=O)CCC[N+]1=CC=CC=C1
| PubChem CID | 84929 |
|---|---|
| CAS | 15471-17-7 |
| Molecular Weight (g/mol) | 201.24 |
| MDL Number | MFCD00064468 |
| SMILES | [O-]S(=O)(=O)CCC[N+]1=CC=CC=C1 |
| Synonym | 3-pyridin-1-ium-1-yl propane-1-sulfonate,ndsb-201,1-3-sulphonatopropyl pyridinium,unii-qn4i6ai9ek,3-1-pyridinio-1-propanesulfonate,1-pyridiniumpropane-3-sulfonate,qn4i6ai9ek,1-3-sulfopropyl pyridinium hydroxide, inner salt,pyridinium, 1-3-sulfopropyl-, inner salt,1-3-sulfonatopropyl pyridin-1-ium |
| IUPAC Name | 3-pyridin-1-ium-1-ylpropane-1-sulfonate |
| InChI Key | REEBJQTUIJTGAL-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO3S |
7-Methyl-1,2,3,4-tetrahydro-1,8-naphthyridine, 95%, Thermo Scientific Chemicals
CAS: 274676-47-0 Molecular Formula: C9H12N2 Molecular Weight (g/mol): 148.209 MDL Number: MFCD06739289 InChI Key: HBWCJMBLUCNJIS-UHFFFAOYSA-N Synonym: 2-methyl-5,6,7,8-tetrahydro-1,8-naphthyridine,7-methyl-1,2,3,4-tetrahydro-1,8 naphthyridine,7-methyl-1,2,3,4-tetrahydropyridino 2,3-b pyridine,1,2,3,4-tetrahydro-7-methyl-1,8-naphthyridine,1,8-naphthyridine, 1,2,3,4-tetrahydro-7-methyl-9ci PubChem CID: 22319466 IUPAC Name: 7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine SMILES: CC1=NC2=C(CCCN2)C=C1
| PubChem CID | 22319466 |
|---|---|
| CAS | 274676-47-0 |
| Molecular Weight (g/mol) | 148.209 |
| MDL Number | MFCD06739289 |
| SMILES | CC1=NC2=C(CCCN2)C=C1 |
| Synonym | 2-methyl-5,6,7,8-tetrahydro-1,8-naphthyridine,7-methyl-1,2,3,4-tetrahydro-1,8 naphthyridine,7-methyl-1,2,3,4-tetrahydropyridino 2,3-b pyridine,1,2,3,4-tetrahydro-7-methyl-1,8-naphthyridine,1,8-naphthyridine, 1,2,3,4-tetrahydro-7-methyl-9ci |
| IUPAC Name | 7-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine |
| InChI Key | HBWCJMBLUCNJIS-UHFFFAOYSA-N |
| Molecular Formula | C9H12N2 |
4-Methylpyridine-3-carboxylic acid, 97%
CAS: 3222-50-2 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00128869 InChI Key: ZKUZSTXNVMIDCY-UHFFFAOYSA-N Synonym: 4-methylnicotinic acid,4-methylpyridine-3-carboxylicacid,4-methyl-3-pyridinecarboxylic acid,3-pyridinecarboxylic acid, 4-methyl,4-methyl-nicotinic acid,pubchem16270,acmc-1ags3,ksc223o4t,cbi-bb zero/009371,3-pyridinecarboxylic acid,4-methyl PubChem CID: 229163 IUPAC Name: 4-methylpyridine-3-carboxylic acid SMILES: CC1=C(C=NC=C1)C(=O)O
| PubChem CID | 229163 |
|---|---|
| CAS | 3222-50-2 |
| Molecular Weight (g/mol) | 137.14 |
| MDL Number | MFCD00128869 |
| SMILES | CC1=C(C=NC=C1)C(=O)O |
| Synonym | 4-methylnicotinic acid,4-methylpyridine-3-carboxylicacid,4-methyl-3-pyridinecarboxylic acid,3-pyridinecarboxylic acid, 4-methyl,4-methyl-nicotinic acid,pubchem16270,acmc-1ags3,ksc223o4t,cbi-bb zero/009371,3-pyridinecarboxylic acid,4-methyl |
| IUPAC Name | 4-methylpyridine-3-carboxylic acid |
| InChI Key | ZKUZSTXNVMIDCY-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
6-Phenylpyrid-3-ylamine, 97%, Thermo Scientific™
CAS: 126370-67-0 Molecular Formula: C11H10N2 Molecular Weight (g/mol): 170.22 MDL Number: MFCD04114197 InChI Key: FLIQYTXJLWGVBG-UHFFFAOYSA-N Synonym: 6-phenyl-3-pyridinamine,5-amino-2-phenylpyridine,6-phenylpyrid-3-ylamine,3-amino-6-phenylpyridine,3-pyridinamine,6-phenyl,6-phenyl-pyridin-3-ylamine,6-phenylpyridine-3-amine,6-phenyl-3-pyridylamine,acmc-1c4ss,5-amino-2-phenyl pyridine PubChem CID: 2762877 IUPAC Name: 6-phenylpyridin-3-amine SMILES: NC1=CN=C(C=C1)C1=CC=CC=C1
| PubChem CID | 2762877 |
|---|---|
| CAS | 126370-67-0 |
| Molecular Weight (g/mol) | 170.22 |
| MDL Number | MFCD04114197 |
| SMILES | NC1=CN=C(C=C1)C1=CC=CC=C1 |
| Synonym | 6-phenyl-3-pyridinamine,5-amino-2-phenylpyridine,6-phenylpyrid-3-ylamine,3-amino-6-phenylpyridine,3-pyridinamine,6-phenyl,6-phenyl-pyridin-3-ylamine,6-phenylpyridine-3-amine,6-phenyl-3-pyridylamine,acmc-1c4ss,5-amino-2-phenyl pyridine |
| IUPAC Name | 6-phenylpyridin-3-amine |
| InChI Key | FLIQYTXJLWGVBG-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2 |
2-Bromo-5-(trifluoromethyl)pyridine, 96%
CAS: 50488-42-1 Molecular Formula: C6H3BrF3N Molecular Weight (g/mol): 225.996 MDL Number: MFCD00153086 InChI Key: GSKMWMFOQQBVMI-UHFFFAOYSA-N Synonym: 2-bromo-5-trifluoromethyl pyridine,6-bromo-3-trifluoromethylpyridine,2-bromo-5-trifluoromethyl-pyridine,pyridine, 2-bromo-5-trifluoromethyl,5-trifluoromethyl-2-bromopyridine,2-brom-5-trifluormethyl pyridin,2-bromo-5-trilfuoromethylpyridine,pubchem3005 PubChem CID: 2736434 IUPAC Name: 2-bromo-5-(trifluoromethyl)pyridine SMILES: C1=CC(=NC=C1C(F)(F)F)Br
| PubChem CID | 2736434 |
|---|---|
| CAS | 50488-42-1 |
| Molecular Weight (g/mol) | 225.996 |
| MDL Number | MFCD00153086 |
| SMILES | C1=CC(=NC=C1C(F)(F)F)Br |
| Synonym | 2-bromo-5-trifluoromethyl pyridine,6-bromo-3-trifluoromethylpyridine,2-bromo-5-trifluoromethyl-pyridine,pyridine, 2-bromo-5-trifluoromethyl,5-trifluoromethyl-2-bromopyridine,2-brom-5-trifluormethyl pyridin,2-bromo-5-trilfuoromethylpyridine,pubchem3005 |
| IUPAC Name | 2-bromo-5-(trifluoromethyl)pyridine |
| InChI Key | GSKMWMFOQQBVMI-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrF3N |
Ethylene chlorophosphite, 97%
CAS: 822-39-9 Molecular Formula: C2H4ClO2P Molecular Weight (g/mol): 126.476 MDL Number: MFCD00014511 InChI Key: OLSFRDLMFAOSIA-UHFFFAOYSA-N PubChem CID: 69973 IUPAC Name: 2-chloro-1,3,2-dioxaphospholane SMILES: C1COP(O1)Cl
| PubChem CID | 69973 |
|---|---|
| CAS | 822-39-9 |
| Molecular Weight (g/mol) | 126.476 |
| MDL Number | MFCD00014511 |
| SMILES | C1COP(O1)Cl |
| IUPAC Name | 2-chloro-1,3,2-dioxaphospholane |
| InChI Key | OLSFRDLMFAOSIA-UHFFFAOYSA-N |
| Molecular Formula | C2H4ClO2P |
2-Chloro-1,3,2-dioxaphospholane-2-oxide, 95%
CAS: 6609-64-9 Molecular Formula: C2H4ClO3P Molecular Weight (g/mol): 142.48 MDL Number: MFCD00043138 InChI Key: SBMUNILHNJLMBF-UHFFFAOYSA-N Synonym: 2-chloro-2-oxo-1,3,2-dioxaphospholane,ethylene chlorophosphate,2-chloro-1,3,2-dioxaphospholane-2-oxide,2-chloro-1,3,2-dioxaphospholane 2-oxide,ethylene glycol chlorophosphate,soqdebhb^bsvusup@,2-chloro-1,3,2??-dioxaphospholan-2-one,2-chlor-1,3,2-dioxaphospholan-2-oxid,acmc-1b2u0,ethylene cycl-chlorophosphate PubChem CID: 81087 IUPAC Name: 2-chloro-1,3,2$l^{5}-dioxaphospholane 2-oxide SMILES: C1COP(=O)(O1)Cl
| PubChem CID | 81087 |
|---|---|
| CAS | 6609-64-9 |
| Molecular Weight (g/mol) | 142.48 |
| MDL Number | MFCD00043138 |
| SMILES | C1COP(=O)(O1)Cl |
| Synonym | 2-chloro-2-oxo-1,3,2-dioxaphospholane,ethylene chlorophosphate,2-chloro-1,3,2-dioxaphospholane-2-oxide,2-chloro-1,3,2-dioxaphospholane 2-oxide,ethylene glycol chlorophosphate,soqdebhb^bsvusup@,2-chloro-1,3,2??-dioxaphospholan-2-one,2-chlor-1,3,2-dioxaphospholan-2-oxid,acmc-1b2u0,ethylene cycl-chlorophosphate |
| IUPAC Name | 2-chloro-1,3,2$l^{5}-dioxaphospholane 2-oxide |
| InChI Key | SBMUNILHNJLMBF-UHFFFAOYSA-N |
| Molecular Formula | C2H4ClO3P |
Cefsulodin Sodium Salt MP Biomedicals
CAS: 52152-93-9 Molecular Formula: C22H21N4NaO8S2+ Molecular Weight (g/mol): 556.54 InChI Key: GTZPOHRNWUTXNB-DWBVFMGKSA-O PubChem CID: 124203950 IUPAC Name: (6R,7R)-3-[(4-carbamoylpyridin-1-ium-1-yl)methyl]-8-oxo-7-[[(2R)-2-phenyl-2-sulfoacetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;sodium SMILES: C1C(=C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)C(=O)O)C[N+]4=CC=C(C=C4)C(=O)N.[Na]
| PubChem CID | 124203950 |
|---|---|
| CAS | 52152-93-9 |
| Molecular Weight (g/mol) | 556.54 |
| SMILES | C1C(=C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)C(=O)O)C[N+]4=CC=C(C=C4)C(=O)N.[Na] |
| IUPAC Name | (6R,7R)-3-[(4-carbamoylpyridin-1-ium-1-yl)methyl]-8-oxo-7-[[(2R)-2-phenyl-2-sulfoacetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;sodium |
| InChI Key | GTZPOHRNWUTXNB-DWBVFMGKSA-O |
| Molecular Formula | C22H21N4NaO8S2+ |
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 |
4-Chloro-N-methylpyridine-2-carboxamide, 97%
CAS: 220000-87-3 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.60 MDL Number: MFCD02185921 InChI Key: BGVBBMZMEKXUTR-UHFFFAOYSA-N Synonym: 4-chloro-n-methylpicolinamide,n-methyl-4-chloropyridine-2-carboxamide,4-chloro-n-methyl-2-pyridinecarboxamide,n-methyl 4-chloropicolinamide,2-pyridinecarboxamide, 4-chloro-n-methyl,4-chloropyridine-2-carboxylic acid methylamide,4-chloro-n-methyl-pyridine-2-carboxamide,n-methyl-4-chloro-2-pyridinamide,4-chloro 2-pyridyl-n-methylcarboxamide,4-chloranyl-∼ n-methyl-pyridine-2-carboxamide PubChem CID: 1476814 IUPAC Name: 4-chloro-N-methylpyridine-2-carboxamide SMILES: CNC(=O)C1=NC=CC(Cl)=C1
| PubChem CID | 1476814 |
|---|---|
| CAS | 220000-87-3 |
| Molecular Weight (g/mol) | 170.60 |
| MDL Number | MFCD02185921 |
| SMILES | CNC(=O)C1=NC=CC(Cl)=C1 |
| Synonym | 4-chloro-n-methylpicolinamide,n-methyl-4-chloropyridine-2-carboxamide,4-chloro-n-methyl-2-pyridinecarboxamide,n-methyl 4-chloropicolinamide,2-pyridinecarboxamide, 4-chloro-n-methyl,4-chloropyridine-2-carboxylic acid methylamide,4-chloro-n-methyl-pyridine-2-carboxamide,n-methyl-4-chloro-2-pyridinamide,4-chloro 2-pyridyl-n-methylcarboxamide,4-chloranyl-∼ n-methyl-pyridine-2-carboxamide |
| IUPAC Name | 4-chloro-N-methylpyridine-2-carboxamide |
| InChI Key | BGVBBMZMEKXUTR-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClN2O |
2-Amino-6-bromopyridine, 98%
CAS: 19798-81-3 Molecular Formula: C5H6BrN2 Molecular Weight (g/mol): 174.02 MDL Number: MFCD00137843 InChI Key: BKLJUYPLUWUEOQ-UHFFFAOYSA-O Synonym: 2-amino-6-bromopyridine,6-bromo-2-pyridinamine,aminobromopyridine,6-bromo-2-aminopyridine,6-bromo-pyridin-2-ylamine,2-pyridinamine, 6-bromo,6-bromo-2-pyridylamine,2-amino-6-bromo-pyridine,zlchem 805,pubchem7663 PubChem CID: 300809 IUPAC Name: 6-bromopyridin-2-amine SMILES: NC1=CC=CC(Br)=[NH+]1
| PubChem CID | 300809 |
|---|---|
| CAS | 19798-81-3 |
| Molecular Weight (g/mol) | 174.02 |
| MDL Number | MFCD00137843 |
| SMILES | NC1=CC=CC(Br)=[NH+]1 |
| Synonym | 2-amino-6-bromopyridine,6-bromo-2-pyridinamine,aminobromopyridine,6-bromo-2-aminopyridine,6-bromo-pyridin-2-ylamine,2-pyridinamine, 6-bromo,6-bromo-2-pyridylamine,2-amino-6-bromo-pyridine,zlchem 805,pubchem7663 |
| IUPAC Name | 6-bromopyridin-2-amine |
| InChI Key | BKLJUYPLUWUEOQ-UHFFFAOYSA-O |
| Molecular Formula | C5H6BrN2 |
3-(4,5-Dimethyl-2-thazolyl)-2,5-diphenyl-2H-tetrazolium bromide, ∽98%, MP Biomedicals™
CAS: 298-93-1 Molecular Formula: C18H16BrN5S Molecular Weight (g/mol): 414.33 MDL Number: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Synonym: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 64965 |
|---|---|
| CAS | 298-93-1 |
| Molecular Weight (g/mol) | 414.33 |
| ChEBI | CHEBI:53233 |
| MDL Number | MFCD00011964,MFCD00066662 |
| SMILES | [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i |
| InChI Key | AZKSAVLVSZKNRD-UHFFFAOYSA-M |
| Molecular Formula | C18H16BrN5S |
N-Acetonylpyridinium chloride, 97%
CAS: 42508-60-1 Molecular Formula: C8H10ClNO Molecular Weight (g/mol): 171.62 MDL Number: MFCD00031949 InChI Key: JHYYWKUENNZTMD-UHFFFAOYSA-M Synonym: 1-acetonylpyridinium chloride,n-acetonylpyridinium chloride,1-2-oxopropyl pyridinium chloride,1-2-oxopropyl pyridin-1-ium chloride,acmc-209jpw,1-acetonylpyridiniumchloride,1-pyridin-1-ium-1-ylpropan-2-one chloride,1-2-oxopropyl-2h-pyridin-2-ylium chloride PubChem CID: 2734121 SMILES: [Cl-].CC(=O)C[N+]1=CC=CC=C1
| PubChem CID | 2734121 |
|---|---|
| CAS | 42508-60-1 |
| Molecular Weight (g/mol) | 171.62 |
| MDL Number | MFCD00031949 |
| SMILES | [Cl-].CC(=O)C[N+]1=CC=CC=C1 |
| Synonym | 1-acetonylpyridinium chloride,n-acetonylpyridinium chloride,1-2-oxopropyl pyridinium chloride,1-2-oxopropyl pyridin-1-ium chloride,acmc-209jpw,1-acetonylpyridiniumchloride,1-pyridin-1-ium-1-ylpropan-2-one chloride,1-2-oxopropyl-2h-pyridin-2-ylium chloride |
| InChI Key | JHYYWKUENNZTMD-UHFFFAOYSA-M |
| Molecular Formula | C8H10ClNO |
Thermo Scientific™ 2,5-Dihydro-2,5-dimethoxyfuran, cis + trans, 99%
CAS: 332-77-4 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.14 MDL Number: MFCD00003220 InChI Key: WXFWXFIWDGJRSC-UHFFFAOYNA-N Synonym: 2,5-Dimethoxy-2,5-dihydrofuran; IUPAC Name: 2,5-dimethoxy-2,5-dihydrofuran SMILES: COC1OC(OC)C=C1
| CAS | 332-77-4 |
|---|---|
| Molecular Weight (g/mol) | 130.14 |
| MDL Number | MFCD00003220 |
| SMILES | COC1OC(OC)C=C1 |
| Synonym | 2,5-Dimethoxy-2,5-dihydrofuran; |
| IUPAC Name | 2,5-dimethoxy-2,5-dihydrofuran |
| InChI Key | WXFWXFIWDGJRSC-UHFFFAOYNA-N |
| Molecular Formula | C6H10O3 |