Organoheterocyclic compounds
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6-Methylbenzimidazole-5-carboxylic acid hydrochloride, 97%
CAS: 10351-76-5 Molecular Formula: C9H9ClN2O2 Molecular Weight (g/mol): 212.633 MDL Number: MFCD09909565 InChI Key: QCJPDBNTTAJIRH-UHFFFAOYSA-N Synonym: 6-methyl-1h-1,3-benzodiazole-5-carboxylic acid,6-methyl-5-benzimidazole carboxylic acid,1h-benzimidazole-5-carboxylic acid,6-methyl,1h-benzimidazole-5-carboxylicacid, 6-methyl,1h-benzimidazole-6-carboxylicacid, 5-methyl,5-methyl-3h-benzoimidazole-6-carboxylic acid,5-methyl-1h-benzo d imidazole-6-carboxylic acid,1h-benzimidazole-5-carboxylic acid, 6-methyl-9ci PubChem CID: 45925698 IUPAC Name: 6-methyl-1H-benzimidazole-5-carboxylic acid;hydrochloride SMILES: CC1=CC2=C(C=C1C(=O)O)N=CN2.Cl
| PubChem CID | 45925698 |
|---|---|
| CAS | 10351-76-5 |
| Molecular Weight (g/mol) | 212.633 |
| MDL Number | MFCD09909565 |
| SMILES | CC1=CC2=C(C=C1C(=O)O)N=CN2.Cl |
| Synonym | 6-methyl-1h-1,3-benzodiazole-5-carboxylic acid,6-methyl-5-benzimidazole carboxylic acid,1h-benzimidazole-5-carboxylic acid,6-methyl,1h-benzimidazole-5-carboxylicacid, 6-methyl,1h-benzimidazole-6-carboxylicacid, 5-methyl,5-methyl-3h-benzoimidazole-6-carboxylic acid,5-methyl-1h-benzo d imidazole-6-carboxylic acid,1h-benzimidazole-5-carboxylic acid, 6-methyl-9ci |
| IUPAC Name | 6-methyl-1H-benzimidazole-5-carboxylic acid;hydrochloride |
| InChI Key | QCJPDBNTTAJIRH-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClN2O2 |
2-(Chloromethyl)-2-methyloxirane, 97%, Thermo Scientific™
CAS: 598-09-4 Molecular Formula: C4H7ClO Molecular Weight (g/mol): 106.549 MDL Number: MFCD00052487 InChI Key: VVHFXJOCUKBZFS-UHFFFAOYSA-N Synonym: 2-chloromethyl-2-methyloxirane,oxirane, 2-chloromethyl-2-methyl,2-chloromethyl-2-methyl-oxirane,2-chloromethyl-1,2-epoxypropane,methyl epichlorohydrin,2-methylepichlorohydrin,acmc-209mfx,beta-methylepichlorohydrin,ksc493o4b PubChem CID: 95220 IUPAC Name: 2-(chloromethyl)-2-methyloxirane SMILES: CC1(CO1)CCl
| PubChem CID | 95220 |
|---|---|
| CAS | 598-09-4 |
| Molecular Weight (g/mol) | 106.549 |
| MDL Number | MFCD00052487 |
| SMILES | CC1(CO1)CCl |
| Synonym | 2-chloromethyl-2-methyloxirane,oxirane, 2-chloromethyl-2-methyl,2-chloromethyl-2-methyl-oxirane,2-chloromethyl-1,2-epoxypropane,methyl epichlorohydrin,2-methylepichlorohydrin,acmc-209mfx,beta-methylepichlorohydrin,ksc493o4b |
| IUPAC Name | 2-(chloromethyl)-2-methyloxirane |
| InChI Key | VVHFXJOCUKBZFS-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO |
2-Methyl-1,5-diphenyl-1H-pyrrole-3-carboxylic acid, 97%, Thermo Scientific™
CAS: 109812-64-8 Molecular Formula: C18H15NO2 Molecular Weight (g/mol): 277.323 MDL Number: MFCD01567220 InChI Key: DWIYTBRYOQDHTE-UHFFFAOYSA-N Synonym: 2-methyl-1,5-diphenyl-1h-pyrrole-3-carboxylic acid,1,5-diphenyl-2-methylpyrrole-3-carboxylic acid,2-methyl-1,5-diphenyl-3-pyrrolecarboxylic acid,1h-pyrrole-3-carboxylicacid, 2-methyl-1,5-diphenyl,maybridge1_008589,acmc-20mclm,2-methyl-1,5-diphenyl-pyrrole-3-carboxylic acid PubChem CID: 2735512 IUPAC Name: 2-methyl-1,5-diphenylpyrrole-3-carboxylic acid SMILES: CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O
| PubChem CID | 2735512 |
|---|---|
| CAS | 109812-64-8 |
| Molecular Weight (g/mol) | 277.323 |
| MDL Number | MFCD01567220 |
| SMILES | CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O |
| Synonym | 2-methyl-1,5-diphenyl-1h-pyrrole-3-carboxylic acid,1,5-diphenyl-2-methylpyrrole-3-carboxylic acid,2-methyl-1,5-diphenyl-3-pyrrolecarboxylic acid,1h-pyrrole-3-carboxylicacid, 2-methyl-1,5-diphenyl,maybridge1_008589,acmc-20mclm,2-methyl-1,5-diphenyl-pyrrole-3-carboxylic acid |
| IUPAC Name | 2-methyl-1,5-diphenylpyrrole-3-carboxylic acid |
| InChI Key | DWIYTBRYOQDHTE-UHFFFAOYSA-N |
| Molecular Formula | C18H15NO2 |
2,2'-Biquinoline, 98%
CAS: 119-91-5 Molecular Formula: C18H12N2 Molecular Weight (g/mol): 256.3 MDL Number: MFCD00006740 InChI Key: WPTCSQBWLUUYDV-UHFFFAOYSA-N Synonym: 2,2'-biquinoline,cuproin,cuproine,2,2'-diquinolyl,2,2'-biquinolyl,2,2'-quinolyl,2-2-quinolyl quinoline,2,2-biquinoline,2,2-diquinolyl,2,2;-biquinoline PubChem CID: 8412 IUPAC Name: 2-quinolin-2-ylquinoline SMILES: C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4C=C3
| PubChem CID | 8412 |
|---|---|
| CAS | 119-91-5 |
| Molecular Weight (g/mol) | 256.3 |
| MDL Number | MFCD00006740 |
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4C=C3 |
| Synonym | 2,2'-biquinoline,cuproin,cuproine,2,2'-diquinolyl,2,2'-biquinolyl,2,2'-quinolyl,2-2-quinolyl quinoline,2,2-biquinoline,2,2-diquinolyl,2,2;-biquinoline |
| IUPAC Name | 2-quinolin-2-ylquinoline |
| InChI Key | WPTCSQBWLUUYDV-UHFFFAOYSA-N |
| Molecular Formula | C18H12N2 |
Dimidium bromide, 95%
CAS: 518-67-2 Molecular Formula: C20H18BrN3 Molecular Weight (g/mol): 380.29 MDL Number: MFCD00011757 InChI Key: MQOKYEROIFEEBH-UHFFFAOYSA-N Synonym: dimidium bromide,trypadine,3,8-diamino-5-methyl-6-phenylphenanthridinium bromide,phenanthridinium 1553,phenanthridinium compound 1553,phenanthridinium, 3,8-diamino-5-methyl-6-phenyl-, bromide,2,7-diamino-10-methyl-9-phenylphenanthridinium bromide,3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide,phenanthridium 1553 PubChem CID: 68207 IUPAC Name: 5-methyl-6-phenylphenanthridin-5-ium-3,8-diamine;bromide SMILES: [Br-].C[N+]1=C(C2=CC=CC=C2)C2=CC(N)=CC=C2C2=CC=C(N)C=C12
| PubChem CID | 68207 |
|---|---|
| CAS | 518-67-2 |
| Molecular Weight (g/mol) | 380.29 |
| MDL Number | MFCD00011757 |
| SMILES | [Br-].C[N+]1=C(C2=CC=CC=C2)C2=CC(N)=CC=C2C2=CC=C(N)C=C12 |
| Synonym | dimidium bromide,trypadine,3,8-diamino-5-methyl-6-phenylphenanthridinium bromide,phenanthridinium 1553,phenanthridinium compound 1553,phenanthridinium, 3,8-diamino-5-methyl-6-phenyl-, bromide,2,7-diamino-10-methyl-9-phenylphenanthridinium bromide,3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide,phenanthridium 1553 |
| IUPAC Name | 5-methyl-6-phenylphenanthridin-5-ium-3,8-diamine;bromide |
| InChI Key | MQOKYEROIFEEBH-UHFFFAOYSA-N |
| Molecular Formula | C20H18BrN3 |
4,6-Dichloropyrimidine, 97%
CAS: 1193-21-1 Molecular Formula: C4H2Cl2N2 Molecular Weight (g/mol): 148.97 MDL Number: MFCD00006109 InChI Key: XJPZKYIHCLDXST-UHFFFAOYSA-N Synonym: pyrimidine, 4,6-dichloro,4,6-dichloro-pyrimidine,4,6-dichloro pyrimidine,4,6-dichloro-1,3-diazine,4,6-dichlorpyrimidin,dichloropyrmidine,dichloropyrimidine,zlchem 225,pubchem6913,4,6-dichloropyrimdine PubChem CID: 70943 IUPAC Name: 4,6-dichloropyrimidine SMILES: ClC1=CC(Cl)=NC=N1
| PubChem CID | 70943 |
|---|---|
| CAS | 1193-21-1 |
| Molecular Weight (g/mol) | 148.97 |
| MDL Number | MFCD00006109 |
| SMILES | ClC1=CC(Cl)=NC=N1 |
| Synonym | pyrimidine, 4,6-dichloro,4,6-dichloro-pyrimidine,4,6-dichloro pyrimidine,4,6-dichloro-1,3-diazine,4,6-dichlorpyrimidin,dichloropyrmidine,dichloropyrimidine,zlchem 225,pubchem6913,4,6-dichloropyrimdine |
| IUPAC Name | 4,6-dichloropyrimidine |
| InChI Key | XJPZKYIHCLDXST-UHFFFAOYSA-N |
| Molecular Formula | C4H2Cl2N2 |
2-Thiohydantoin, 98%
CAS: 503-87-7 Molecular Formula: C3H4N2OS Molecular Weight (g/mol): 116.14 MDL Number: MFCD00005277 InChI Key: UGWULZWUXSCWPX-UHFFFAOYSA-N Synonym: 2-thiohydantoin,thiohydantoin,4-imidazolidinone, 2-thioxo,2-thioxoimidazolidin-4-one,2-thioguidanthion,hydantoin, 2-thio,usaf be-25,2-thioxo-4-imidazolidinone,2-thioxo-1,3-diazolidin-4-one,glycine thiohydantoin PubChem CID: 1274030 IUPAC Name: 2-sulfanylideneimidazolidin-4-one SMILES: O=C1CNC(=S)N1
| PubChem CID | 1274030 |
|---|---|
| CAS | 503-87-7 |
| Molecular Weight (g/mol) | 116.14 |
| MDL Number | MFCD00005277 |
| SMILES | O=C1CNC(=S)N1 |
| Synonym | 2-thiohydantoin,thiohydantoin,4-imidazolidinone, 2-thioxo,2-thioxoimidazolidin-4-one,2-thioguidanthion,hydantoin, 2-thio,usaf be-25,2-thioxo-4-imidazolidinone,2-thioxo-1,3-diazolidin-4-one,glycine thiohydantoin |
| IUPAC Name | 2-sulfanylideneimidazolidin-4-one |
| InChI Key | UGWULZWUXSCWPX-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2OS |
2-Amino-5-nitrothiazole, 97%
CAS: 121-66-4 Molecular Formula: C3H3N3O2S Molecular Weight (g/mol): 145.14 MDL Number: MFCD00005326 InChI Key: MIHADVKEHAFNPG-UHFFFAOYSA-N Synonym: 2-amino-5-nitrothiazole,5-nitrothiazol-2-amine,enheptin,entramin,2-thiazolamine, 5-nitro,nitramin ido,amnizol soluble,enheptin-t,5-nitro-2-thiazolamine,enheptin premix PubChem CID: 8486 ChEBI: CHEBI:82386 IUPAC Name: 5-nitro-1,3-thiazol-2-amine SMILES: NC1=NC=C(S1)[N+]([O-])=O
| PubChem CID | 8486 |
|---|---|
| CAS | 121-66-4 |
| Molecular Weight (g/mol) | 145.14 |
| ChEBI | CHEBI:82386 |
| MDL Number | MFCD00005326 |
| SMILES | NC1=NC=C(S1)[N+]([O-])=O |
| Synonym | 2-amino-5-nitrothiazole,5-nitrothiazol-2-amine,enheptin,entramin,2-thiazolamine, 5-nitro,nitramin ido,amnizol soluble,enheptin-t,5-nitro-2-thiazolamine,enheptin premix |
| IUPAC Name | 5-nitro-1,3-thiazol-2-amine |
| InChI Key | MIHADVKEHAFNPG-UHFFFAOYSA-N |
| Molecular Formula | C3H3N3O2S |
2-Amino-4-tert-butylthiazole, 98%
CAS: 74370-93-7 Molecular Formula: C7H12N2S Molecular Weight (g/mol): 156.247 MDL Number: MFCD00051644 InChI Key: CUWZBHVYLVGOAB-UHFFFAOYSA-N Synonym: 2-amino-4-tert-butylthiazole,4-tert-butylthiazol-2-ylamine,4-tert-butyl thiazol-2-amine,4-tert-butyl-thiazol-2-ylamine,2-amino-4-t-butylthiazole,4-tert-butyl-1,3-thiazol-2-amine,4-tert-butylthiazol-2-amine,4-tert-butyl-1,3-thiazol-2-ylamine,2-thiazolamine, 4-1,1-dimethylethyl,4-tert-butyl-1,3-thiazole-2-ylamine PubChem CID: 2734202 IUPAC Name: 4-tert-butyl-1,3-thiazol-2-amine SMILES: CC(C)(C)C1=CSC(=N1)N
| PubChem CID | 2734202 |
|---|---|
| CAS | 74370-93-7 |
| Molecular Weight (g/mol) | 156.247 |
| MDL Number | MFCD00051644 |
| SMILES | CC(C)(C)C1=CSC(=N1)N |
| Synonym | 2-amino-4-tert-butylthiazole,4-tert-butylthiazol-2-ylamine,4-tert-butyl thiazol-2-amine,4-tert-butyl-thiazol-2-ylamine,2-amino-4-t-butylthiazole,4-tert-butyl-1,3-thiazol-2-amine,4-tert-butylthiazol-2-amine,4-tert-butyl-1,3-thiazol-2-ylamine,2-thiazolamine, 4-1,1-dimethylethyl,4-tert-butyl-1,3-thiazole-2-ylamine |
| IUPAC Name | 4-tert-butyl-1,3-thiazol-2-amine |
| InChI Key | CUWZBHVYLVGOAB-UHFFFAOYSA-N |
| Molecular Formula | C7H12N2S |
6-Chloro-7-deazapurine, 98%
CAS: 3680-69-1 Molecular Formula: C6H4ClN3 Molecular Weight (g/mol): 153.569 MDL Number: MFCD01686865 InChI Key: BPTCCCTWWAUJRK-UHFFFAOYSA-N Synonym: 4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazapurine,4-chloro-1h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 4-chloro,1h-pyrrolo 2,3-d pyrimidine, 4-chloro,6-chloro-7-deazapurine 4-chloro-1h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrol 2,3-d pyrimidine PubChem CID: 5356682 IUPAC Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidine SMILES: C1=CNC2=C1C(=NC=N2)Cl
| PubChem CID | 5356682 |
|---|---|
| CAS | 3680-69-1 |
| Molecular Weight (g/mol) | 153.569 |
| MDL Number | MFCD01686865 |
| SMILES | C1=CNC2=C1C(=NC=N2)Cl |
| Synonym | 4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazapurine,4-chloro-1h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 4-chloro,1h-pyrrolo 2,3-d pyrimidine, 4-chloro,6-chloro-7-deazapurine 4-chloro-1h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrol 2,3-d pyrimidine |
| IUPAC Name | 4-chloro-7H-pyrrolo[2,3-d]pyrimidine |
| InChI Key | BPTCCCTWWAUJRK-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClN3 |
4-Chloro-3-(hydroxymethyl)pyridine hydrochloride, 98%, Thermo Scientific Chemicals
CAS: 245124-17-8 Molecular Formula: C6H7Cl2NO Molecular Weight (g/mol): 180.028 MDL Number: MFCD23703142 InChI Key: OPXGRFCMPCHNIY-UHFFFAOYSA-N Synonym: 4-chloropyridin-3-yl methanol hydrochloride,4-chloropyridin-3-yl methanol hcl,4-chloro-3-pyridinemethanol hydrochloride,4-chloro-3-pyridyl methanol hydrochloride,4-chloropyridin-3-yl methanol-hydrogen chloride 1/1 PubChem CID: 71607202 IUPAC Name: (4-chloropyridin-3-yl)methanol;hydrochloride SMILES: C1=CN=CC(=C1Cl)CO.Cl
| PubChem CID | 71607202 |
|---|---|
| CAS | 245124-17-8 |
| Molecular Weight (g/mol) | 180.028 |
| MDL Number | MFCD23703142 |
| SMILES | C1=CN=CC(=C1Cl)CO.Cl |
| Synonym | 4-chloropyridin-3-yl methanol hydrochloride,4-chloropyridin-3-yl methanol hcl,4-chloro-3-pyridinemethanol hydrochloride,4-chloro-3-pyridyl methanol hydrochloride,4-chloropyridin-3-yl methanol-hydrogen chloride 1/1 |
| IUPAC Name | (4-chloropyridin-3-yl)methanol;hydrochloride |
| InChI Key | OPXGRFCMPCHNIY-UHFFFAOYSA-N |
| Molecular Formula | C6H7Cl2NO |
3-Chloro-2-fluoro-5-hydroxypyridine, 98%, Thermo Scientific Chemicals
CAS: 209328-72-3 Molecular Formula: C5H3ClFNO Molecular Weight (g/mol): 147.533 MDL Number: MFCD08061311 InChI Key: IETLNKVWDZYCPN-UHFFFAOYSA-N PubChem CID: 22451555 IUPAC Name: 5-chloro-6-fluoropyridin-3-ol SMILES: C1=C(C=NC(=C1Cl)F)O
| PubChem CID | 22451555 |
|---|---|
| CAS | 209328-72-3 |
| Molecular Weight (g/mol) | 147.533 |
| MDL Number | MFCD08061311 |
| SMILES | C1=C(C=NC(=C1Cl)F)O |
| IUPAC Name | 5-chloro-6-fluoropyridin-3-ol |
| InChI Key | IETLNKVWDZYCPN-UHFFFAOYSA-N |
| Molecular Formula | C5H3ClFNO |
2-Hydroxy-4-nitropyridine, 96%
CAS: 4487-51-8 Molecular Formula: C5H4N2O3 Molecular Weight (g/mol): 140.10 MDL Number: MFCD04114149 InChI Key: STJAXIFXCBWILG-UHFFFAOYSA-N Synonym: 2-hydroxy-4-nitropyridine,4-nitropyridin-2-ol,4-nitropyrid-2-one,4-nitropyridin-2 1h-one,4-nitro-2-pyridinol,4-nitropyridine-2-ol,4-nitro-2 1h-pyridinone,ksc497o0t,2 1h-pyridinone, 4-nitro,2-hydroxy-4-nitro pyridine PubChem CID: 2762823 IUPAC Name: 4-nitro-1,2-dihydropyridin-2-one SMILES: [O-][N+](=O)C1=CC(=O)NC=C1
| PubChem CID | 2762823 |
|---|---|
| CAS | 4487-51-8 |
| Molecular Weight (g/mol) | 140.10 |
| MDL Number | MFCD04114149 |
| SMILES | [O-][N+](=O)C1=CC(=O)NC=C1 |
| Synonym | 2-hydroxy-4-nitropyridine,4-nitropyridin-2-ol,4-nitropyrid-2-one,4-nitropyridin-2 1h-one,4-nitro-2-pyridinol,4-nitropyridine-2-ol,4-nitro-2 1h-pyridinone,ksc497o0t,2 1h-pyridinone, 4-nitro,2-hydroxy-4-nitro pyridine |
| IUPAC Name | 4-nitro-1,2-dihydropyridin-2-one |
| InChI Key | STJAXIFXCBWILG-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2O3 |
4-Chloroindole-3-acetic acid, 95%
CAS: 2519-61-1 Molecular Formula: C10H8ClNO2 Molecular Weight (g/mol): 209.629 MDL Number: MFCD00216155 InChI Key: WNCFBCKZRJDRKZ-UHFFFAOYSA-N Synonym: 4-chloroindole-3-acetic acid,2-4-chloro-1h-indol-3-yl acetic acid,4-cl-iaa,4-chloroindole-3-acetate,4-chloro-1h-indole-3-acetic acid,1h-indole-3-acetic acid, 4-chloro,4-chloro-3-indolylacetic acid,4-chloroindolyl-3-acetic acid,4-chloro-1h-indol-3-yl acetic acid,4-chloro-iaa PubChem CID: 100413 ChEBI: CHEBI:20339 IUPAC Name: 2-(4-chloro-1H-indol-3-yl)acetic acid SMILES: C1=CC2=C(C(=C1)Cl)C(=CN2)CC(=O)O
| PubChem CID | 100413 |
|---|---|
| CAS | 2519-61-1 |
| Molecular Weight (g/mol) | 209.629 |
| ChEBI | CHEBI:20339 |
| MDL Number | MFCD00216155 |
| SMILES | C1=CC2=C(C(=C1)Cl)C(=CN2)CC(=O)O |
| Synonym | 4-chloroindole-3-acetic acid,2-4-chloro-1h-indol-3-yl acetic acid,4-cl-iaa,4-chloroindole-3-acetate,4-chloro-1h-indole-3-acetic acid,1h-indole-3-acetic acid, 4-chloro,4-chloro-3-indolylacetic acid,4-chloroindolyl-3-acetic acid,4-chloro-1h-indol-3-yl acetic acid,4-chloro-iaa |
| IUPAC Name | 2-(4-chloro-1H-indol-3-yl)acetic acid |
| InChI Key | WNCFBCKZRJDRKZ-UHFFFAOYSA-N |
| Molecular Formula | C10H8ClNO2 |
Benzimidazole-6-carbonitrile, 97%, Thermo Scientific Chemicals
CAS: 6287-83-8 Molecular Formula: C8H5N3 Molecular Weight (g/mol): 143.15 MDL Number: MFCD06809988 InChI Key: NICYTXJGZRYCEQ-UHFFFAOYSA-N Synonym: 1h-benzimidazole-5-carbonitrile,1h-benzo d imidazole-6-carbonitrile,1h-1,3-benzodiazole-5-carbonitrile,1h-benzo d imidazole-5-carbonitrile,5-cyanobenzimidazole,1h-benzimidazole-6-carbonitrile,5-benzimidazolecarbonitrile,benzimidazole-5-carbonitrile,1h-benzoimidazole-5-carbonitrile,3h-1,3-benzodiazole-5-carbonitrile PubChem CID: 223906 IUPAC Name: 1H-1,3-benzodiazole-6-carbonitrile SMILES: N#CC1=CC=C2N=CNC2=C1
| PubChem CID | 223906 |
|---|---|
| CAS | 6287-83-8 |
| Molecular Weight (g/mol) | 143.15 |
| MDL Number | MFCD06809988 |
| SMILES | N#CC1=CC=C2N=CNC2=C1 |
| Synonym | 1h-benzimidazole-5-carbonitrile,1h-benzo d imidazole-6-carbonitrile,1h-1,3-benzodiazole-5-carbonitrile,1h-benzo d imidazole-5-carbonitrile,5-cyanobenzimidazole,1h-benzimidazole-6-carbonitrile,5-benzimidazolecarbonitrile,benzimidazole-5-carbonitrile,1h-benzoimidazole-5-carbonitrile,3h-1,3-benzodiazole-5-carbonitrile |
| IUPAC Name | 1H-1,3-benzodiazole-6-carbonitrile |
| InChI Key | NICYTXJGZRYCEQ-UHFFFAOYSA-N |
| Molecular Formula | C8H5N3 |