N-(2-cyano-3-methyl-butan-2-yl)-2-(1-cyclohexylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-(1-cyclohexylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-(1-cyclohexylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[(1-cyclohexyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-(1-cyclohexylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[(1-cyclohexylbenzimidazol-2-yl)thio]acetamide Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=NC2=CC=CC=C2N1C3CCCCC3

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CSC1=NC2=CC=CC=C2N1C3CCCCC3

InChI

InChI=1S/C21H28N4OS/c1-15(2)21(3,14-22)24-19(26)13-27-20-23-17-11-7-8-12-18(17)25(20)16-9-5-4-6-10-16/h7-8,11-12,15-16H,4-6,9-10,13H2,1-3H3,(H,24,26)