2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]ethanamide

Systemtic Name: 2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]ethanamide Openeye Name: 2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanyl-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]acetamide CAS Name: 2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]-N-[(1R)-1-cyano-1-cyclopropylethyl]acetamide IUPAC Name: 2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanyl-N-[(1R)-1-cyano-1-cyclopropylethyl]acetamide Traditional Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]acetamide Formula: C22H21ClN4OS MolecularWeight: 424.94634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C22H21ClN4OS/c1-22(14-24,16-7-8-16)26-20(28)13-29-21-25-18-11-17(23)9-10-19(18)27(21)12-15-5-3-2-4-6-15/h2-6,9-11,16H,7-8,12-13H2,1H3,(H,26,28)/t22-/m0/s1