N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[(1-phenethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-[(1-phenethylbenzimidazol-2-yl)thio]acetamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=NC2=CC=CC=C2N1CCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)CSC1=NC2=CC=CC=C2N1CCC3=CC=CC=C3

InChI

InChI=1S/C23H26N4OS/c1-17(2)23(3,16-24)26-21(28)15-29-22-25-19-11-7-8-12-20(19)27(22)14-13-18-9-5-4-6-10-18/h4-12,17H,13-15H2,1-3H3,(H,26,28)/t23-/m0/s1