Organoheterocyclic compounds
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3,5-Dichloro-2-cyanopyridine, 95%, Thermo Scientific Chemicals
CAS: 85331-33-5 Molecular Formula: C6H2Cl2N2 Molecular Weight (g/mol): 172.996 MDL Number: MFCD03788758 InChI Key: ATUOLSDAAPMVJJ-UHFFFAOYSA-N Synonym: 3,5-dichloro-2-cyanopyridine,2-cyano-3,5-dichloropyridine,3,5-dichloropicolinonitrile,2-pyridinecarbonitrile, 3,5-dichloro,pubchem2423,acmc-209q5l,ksc448a0l,tpc-py042,3,5-dichloro-2-cyano pyridine,3,5-dichloro-2-pyridinecarbonitrile PubChem CID: 2769699 IUPAC Name: 3,5-dichloropyridine-2-carbonitrile SMILES: C1=C(C=NC(=C1Cl)C#N)Cl
| PubChem CID | 2769699 |
|---|---|
| CAS | 85331-33-5 |
| Molecular Weight (g/mol) | 172.996 |
| MDL Number | MFCD03788758 |
| SMILES | C1=C(C=NC(=C1Cl)C#N)Cl |
| Synonym | 3,5-dichloro-2-cyanopyridine,2-cyano-3,5-dichloropyridine,3,5-dichloropicolinonitrile,2-pyridinecarbonitrile, 3,5-dichloro,pubchem2423,acmc-209q5l,ksc448a0l,tpc-py042,3,5-dichloro-2-cyano pyridine,3,5-dichloro-2-pyridinecarbonitrile |
| IUPAC Name | 3,5-dichloropyridine-2-carbonitrile |
| InChI Key | ATUOLSDAAPMVJJ-UHFFFAOYSA-N |
| Molecular Formula | C6H2Cl2N2 |
1,3-Benzothiazol-5-amine, 97%, Thermo Scientific™
CAS: 1123-93-9 Molecular Formula: C7H6N2S Molecular Weight (g/mol): 150.20 MDL Number: MFCD04115282 InChI Key: UJZYHMZRXGNDFB-UHFFFAOYSA-N Synonym: 5-benzothiazolamine,benzothiazol-5-ylamine,benzo d thiazol-5-amine,benzothiazol-5-amine,5-amino-1,3-benzothiazole,5-aminobenzothiazole,1,3-benzothiazole-5-amine,1,3-benzothiazol-5-ylamine,5-amino-1,3-benzothiazol,5-amino-benzothiazole PubChem CID: 70749 IUPAC Name: 1,3-benzothiazol-5-amine SMILES: NC1=CC=C2SC=NC2=C1
| PubChem CID | 70749 |
|---|---|
| CAS | 1123-93-9 |
| Molecular Weight (g/mol) | 150.20 |
| MDL Number | MFCD04115282 |
| SMILES | NC1=CC=C2SC=NC2=C1 |
| Synonym | 5-benzothiazolamine,benzothiazol-5-ylamine,benzo d thiazol-5-amine,benzothiazol-5-amine,5-amino-1,3-benzothiazole,5-aminobenzothiazole,1,3-benzothiazole-5-amine,1,3-benzothiazol-5-ylamine,5-amino-1,3-benzothiazol,5-amino-benzothiazole |
| IUPAC Name | 1,3-benzothiazol-5-amine |
| InChI Key | UJZYHMZRXGNDFB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2S |
(S)-(-)-3-Aminotetrahydrofuran p-toluenesulfonate salt, 97%
CAS: 104530-79-2 Molecular Formula: C4H9NO Molecular Weight (g/mol): 87.12 MDL Number: MFCD08234425,MFCD07778394 InChI Key: MIPHRQMEIYLZFZ-UHFFFAOYNA-N Synonym: s-3-aminotetrahydrofuran,s-tetrahydrofuran-3-amine,3s-oxolan-3-amine,3-furanamine,tetrahydro-, 3s,s-tetrahydro-furan-3-ylamine,tetrahydrofuran-3beta-amine,s-3-amino-tetrahydrofuran,5-tetrahydrofuran-3-amine,3s-tetrahydro-3-furanamine,3s-tetrahydrofuran-3-amine PubChem CID: 14243168 IUPAC Name: oxolan-3-amine SMILES: NC1CCOC1
| PubChem CID | 14243168 |
|---|---|
| CAS | 104530-79-2 |
| Molecular Weight (g/mol) | 87.12 |
| MDL Number | MFCD08234425,MFCD07778394 |
| SMILES | NC1CCOC1 |
| Synonym | s-3-aminotetrahydrofuran,s-tetrahydrofuran-3-amine,3s-oxolan-3-amine,3-furanamine,tetrahydro-, 3s,s-tetrahydro-furan-3-ylamine,tetrahydrofuran-3beta-amine,s-3-amino-tetrahydrofuran,5-tetrahydrofuran-3-amine,3s-tetrahydro-3-furanamine,3s-tetrahydrofuran-3-amine |
| IUPAC Name | oxolan-3-amine |
| InChI Key | MIPHRQMEIYLZFZ-UHFFFAOYNA-N |
| Molecular Formula | C4H9NO |
Tetramisole hydrochloride, 99.6%, MP Biomedicals™
CAS: 83-67-0 Molecular Formula: C7H8N4O2 Molecular Weight (g/mol): 180.167 InChI Key: YAPQBXQYLJRXSA-UHFFFAOYSA-N Synonym: theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin PubChem CID: 5429 ChEBI: CHEBI:28946 IUPAC Name: 3,7-dimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)NC(=O)N2C
| PubChem CID | 5429 |
|---|---|
| CAS | 83-67-0 |
| Molecular Weight (g/mol) | 180.167 |
| ChEBI | CHEBI:28946 |
| SMILES | CN1C=NC2=C1C(=O)NC(=O)N2C |
| Synonym | theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin |
| IUPAC Name | 3,7-dimethylpurine-2,6-dione |
| InChI Key | YAPQBXQYLJRXSA-UHFFFAOYSA-N |
| Molecular Formula | C7H8N4O2 |
2-Morpholino-1,3-thiazole-5-carboxylic acid, 97%, Thermo Scientific™
CAS: 332345-29-6 Molecular Formula: C8H10N2O3S Molecular Weight (g/mol): 214.239 InChI Key: NILKOMDINYFEEX-UHFFFAOYSA-N Synonym: 2-morpholino-1,3-thiazole-5-carboxylic acid,2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid,2-morpholin-4-yl-thiazole-5-carboxylic acid,5-thiazolecarboxylic acid, 2-4-morpholinyl PubChem CID: 15475835 IUPAC Name: 2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid SMILES: C1COCCN1C2=NC=C(S2)C(=O)O
| PubChem CID | 15475835 |
|---|---|
| CAS | 332345-29-6 |
| Molecular Weight (g/mol) | 214.239 |
| SMILES | C1COCCN1C2=NC=C(S2)C(=O)O |
| Synonym | 2-morpholino-1,3-thiazole-5-carboxylic acid,2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid,2-morpholin-4-yl-thiazole-5-carboxylic acid,5-thiazolecarboxylic acid, 2-4-morpholinyl |
| IUPAC Name | 2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid |
| InChI Key | NILKOMDINYFEEX-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O3S |
5-Bromo-3-fluoropyridine-2-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 669066-91-5 Molecular Formula: C6H3BrFNO2 Molecular Weight (g/mol): 220.00 MDL Number: MFCD07437865 InChI Key: JXHUXOAJAYWMHK-UHFFFAOYSA-N PubChem CID: 21075872 IUPAC Name: 5-bromo-3-fluoropyridine-2-carboxylic acid SMILES: OC(=O)C1=NC=C(Br)C=C1F
| PubChem CID | 21075872 |
|---|---|
| CAS | 669066-91-5 |
| Molecular Weight (g/mol) | 220.00 |
| MDL Number | MFCD07437865 |
| SMILES | OC(=O)C1=NC=C(Br)C=C1F |
| IUPAC Name | 5-bromo-3-fluoropyridine-2-carboxylic acid |
| InChI Key | JXHUXOAJAYWMHK-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrFNO2 |
N-Methylcaprolactam, 96%
CAS: 2556-73-2 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.187 MDL Number: MFCD00003263 InChI Key: ZWXPDGCFMMFNRW-UHFFFAOYSA-N Synonym: n-methylcaprolactam,1-methylcaprolactam,n-methyl-.epsilon.-caprolactam,2h-azepin-2-one, hexahydro-1-methyl,n-methyl-e-caprolactam,epsilon-caprolactam, n-methyl,2h-azepin-2-one, hexahydro-n-methyl,hexahydro-n-methyl-2h-azepin-2-one,n-methyl-epsilon-caprolactam,n-methyl caprolactam PubChem CID: 17369 IUPAC Name: 1-methylazepan-2-one SMILES: CN1CCCCCC1=O
| PubChem CID | 17369 |
|---|---|
| CAS | 2556-73-2 |
| Molecular Weight (g/mol) | 127.187 |
| MDL Number | MFCD00003263 |
| SMILES | CN1CCCCCC1=O |
| Synonym | n-methylcaprolactam,1-methylcaprolactam,n-methyl-.epsilon.-caprolactam,2h-azepin-2-one, hexahydro-1-methyl,n-methyl-e-caprolactam,epsilon-caprolactam, n-methyl,2h-azepin-2-one, hexahydro-n-methyl,hexahydro-n-methyl-2h-azepin-2-one,n-methyl-epsilon-caprolactam,n-methyl caprolactam |
| IUPAC Name | 1-methylazepan-2-one |
| InChI Key | ZWXPDGCFMMFNRW-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO |
3-Aminoazetidine dihydrochloride, 95%
CAS: 102065-89-4 Molecular Formula: C3H8N2 Molecular Weight (g/mol): 72.111 MDL Number: MFCD09910173 InChI Key: FDPKMJDUXJFKOI-UHFFFAOYSA-N Synonym: 3-aminoazetidine,3-azetidinamine,acmc-209y1n,3-aminoazetidine dihy drochloric PubChem CID: 1516506 IUPAC Name: azetidin-3-amine SMILES: C1C(CN1)N
| PubChem CID | 1516506 |
|---|---|
| CAS | 102065-89-4 |
| Molecular Weight (g/mol) | 72.111 |
| MDL Number | MFCD09910173 |
| SMILES | C1C(CN1)N |
| Synonym | 3-aminoazetidine,3-azetidinamine,acmc-209y1n,3-aminoazetidine dihy drochloric |
| IUPAC Name | azetidin-3-amine |
| InChI Key | FDPKMJDUXJFKOI-UHFFFAOYSA-N |
| Molecular Formula | C3H8N2 |
6-Chloropurine, 99%
CAS: 87-42-3 Molecular Formula: C5H3ClN4 Molecular Weight (g/mol): 154.557 MDL Number: MFCD00075825 InChI Key: ZKBQDFAWXLTYKS-UHFFFAOYSA-N Synonym: 6-chloropurine,6-chloro-9h-purine,1h-purine, 6-chloro,6-chloro-1h-purine,purine, 6-chloro,6-cp,6-chlorpurine,6-chloro purine,6-chloropurin,chloropurine, 6 PubChem CID: 5359277 IUPAC Name: 6-chloro-7H-purine SMILES: C1=NC2=C(N1)C(=NC=N2)Cl
| PubChem CID | 5359277 |
|---|---|
| CAS | 87-42-3 |
| Molecular Weight (g/mol) | 154.557 |
| MDL Number | MFCD00075825 |
| SMILES | C1=NC2=C(N1)C(=NC=N2)Cl |
| Synonym | 6-chloropurine,6-chloro-9h-purine,1h-purine, 6-chloro,6-chloro-1h-purine,purine, 6-chloro,6-cp,6-chlorpurine,6-chloro purine,6-chloropurin,chloropurine, 6 |
| IUPAC Name | 6-chloro-7H-purine |
| InChI Key | ZKBQDFAWXLTYKS-UHFFFAOYSA-N |
| Molecular Formula | C5H3ClN4 |
Furo[3,2-b]pyridine, 95%
CAS: 272-62-8 Molecular Formula: C7H5NO Molecular Weight (g/mol): 119.12 MDL Number: MFCD11870744 InChI Key: YRTCKZIKGWZNCU-UHFFFAOYSA-N Synonym: furo 3,2-b pyridine,4-azabenzo b furan,furopyridine,furo 3,2-b pyridin,4-aza-1-benzofuran PubChem CID: 12210217 IUPAC Name: furo[3,2-b]pyridine SMILES: O1C=CC2=NC=CC=C12
| PubChem CID | 12210217 |
|---|---|
| CAS | 272-62-8 |
| Molecular Weight (g/mol) | 119.12 |
| MDL Number | MFCD11870744 |
| SMILES | O1C=CC2=NC=CC=C12 |
| Synonym | furo 3,2-b pyridine,4-azabenzo b furan,furopyridine,furo 3,2-b pyridin,4-aza-1-benzofuran |
| IUPAC Name | furo[3,2-b]pyridine |
| InChI Key | YRTCKZIKGWZNCU-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO |
6-Chloropiperonyl alcohol, 98%
CAS: 2591-25-5 Molecular Formula: C8H7ClO3 Molecular Weight (g/mol): 186.591 MDL Number: MFCD00051727 InChI Key: ADHYYNHCXPPVHQ-UHFFFAOYSA-N Synonym: 6-chloropiperonyl alcohol,6-chloro-2h-1,3-benzodioxol-5-yl methanol,6-chlorobenzo d 1,3 dioxol-5-yl methanol,6-chloro-1,3-benzodioxol-5-yl methanol,2-chlor-4,5-methylendioxy-benzylalkohol,6-chloro-3,4-methylenedioxybenzyl alcohol,6-chloro-2h-benzo d 1,3-dioxolen-5-yl methan-1-ol PubChem CID: 7015319 IUPAC Name: (6-chloro-1,3-benzodioxol-5-yl)methanol SMILES: C1OC2=C(O1)C=C(C(=C2)CO)Cl
| PubChem CID | 7015319 |
|---|---|
| CAS | 2591-25-5 |
| Molecular Weight (g/mol) | 186.591 |
| MDL Number | MFCD00051727 |
| SMILES | C1OC2=C(O1)C=C(C(=C2)CO)Cl |
| Synonym | 6-chloropiperonyl alcohol,6-chloro-2h-1,3-benzodioxol-5-yl methanol,6-chlorobenzo d 1,3 dioxol-5-yl methanol,6-chloro-1,3-benzodioxol-5-yl methanol,2-chlor-4,5-methylendioxy-benzylalkohol,6-chloro-3,4-methylenedioxybenzyl alcohol,6-chloro-2h-benzo d 1,3-dioxolen-5-yl methan-1-ol |
| IUPAC Name | (6-chloro-1,3-benzodioxol-5-yl)methanol |
| InChI Key | ADHYYNHCXPPVHQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO3 |
4-(Tetrahydropyran-4-yloxy)benzoic acid, 97%, Thermo Scientific™
CAS: 851048-51-6 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD09025874 InChI Key: MPNYLYRGNCZFFH-UHFFFAOYSA-N PubChem CID: 24229519 IUPAC Name: 4-(oxan-4-yloxy)benzoic acid SMILES: C1COCCC1OC2=CC=C(C=C2)C(=O)O
| PubChem CID | 24229519 |
|---|---|
| CAS | 851048-51-6 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD09025874 |
| SMILES | C1COCCC1OC2=CC=C(C=C2)C(=O)O |
| IUPAC Name | 4-(oxan-4-yloxy)benzoic acid |
| InChI Key | MPNYLYRGNCZFFH-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
Isocytosine, 99%
CAS: 108-53-2 Molecular Formula: C4H5N3O Molecular Weight (g/mol): 111.10 MDL Number: MFCD00057557 MFCD00023256 InChI Key: XQCZBXHVTFVIFE-UHFFFAOYSA-N Synonym: isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino PubChem CID: 66950 ChEBI: CHEBI:55502 SMILES: NC1=NC=CC(=O)N1
| PubChem CID | 66950 |
|---|---|
| CAS | 108-53-2 |
| Molecular Weight (g/mol) | 111.10 |
| ChEBI | CHEBI:55502 |
| MDL Number | MFCD00057557 MFCD00023256 |
| SMILES | NC1=NC=CC(=O)N1 |
| Synonym | isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino |
| InChI Key | XQCZBXHVTFVIFE-UHFFFAOYSA-N |
| Molecular Formula | C4H5N3O |
3,6-Dibromo-2-chloropyridine, 95%, Thermo Scientific Chemicals
CAS: 942206-18-0 Molecular Formula: C5H2Br2ClN Molecular Weight (g/mol): 271.336 MDL Number: MFCD09037464 InChI Key: CVZSNXGMWIGPBF-UHFFFAOYSA-N Synonym: 2-chloro-3,6-dibromopyridine,3,6-dibromo-2-chloro-pyridine PubChem CID: 42553063 IUPAC Name: 3,6-dibromo-2-chloropyridine SMILES: C1=CC(=NC(=C1Br)Cl)Br
| PubChem CID | 42553063 |
|---|---|
| CAS | 942206-18-0 |
| Molecular Weight (g/mol) | 271.336 |
| MDL Number | MFCD09037464 |
| SMILES | C1=CC(=NC(=C1Br)Cl)Br |
| Synonym | 2-chloro-3,6-dibromopyridine,3,6-dibromo-2-chloro-pyridine |
| IUPAC Name | 3,6-dibromo-2-chloropyridine |
| InChI Key | CVZSNXGMWIGPBF-UHFFFAOYSA-N |
| Molecular Formula | C5H2Br2ClN |
D-Biotin, MP Biomedicals
CAS: 58-85-5 Molecular Formula: C10H16N2O3S Molecular Weight (g/mol): 244.31 MDL Number: MFCD00005541 InChI Key: YBJHBAHKTGYVGT-UHFFFAOYNA-N Synonym: biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin PubChem CID: 171548 ChEBI: CHEBI:15956 IUPAC Name: 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid SMILES: OC(=O)CCCCC1SCC2NC(=O)NC12
| PubChem CID | 171548 |
|---|---|
| CAS | 58-85-5 |
| Molecular Weight (g/mol) | 244.31 |
| ChEBI | CHEBI:15956 |
| MDL Number | MFCD00005541 |
| SMILES | OC(=O)CCCCC1SCC2NC(=O)NC12 |
| Synonym | biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin |
| IUPAC Name | 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid |
| InChI Key | YBJHBAHKTGYVGT-UHFFFAOYNA-N |
| Molecular Formula | C10H16N2O3S |