ethyl 5-azanyl-4-cyano-3-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C19H20N4O3S2/c1-3-26-18(24)16-13(12(10-20)17(21)28-16)11-27-19-22-14-6-4-5-7-15(14)23(19)8-9-25-2/h4-7H,3,8-9,11,21H2,1-2H3