N-(3-chloranyl-4-cyano-phenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]acetamide Formula: C20H19ClN4OS MolecularWeight: 398.90906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H19ClN4OS/c1-13(2)11-25-18-6-4-3-5-17(18)24-20(25)27-12-19(26)23-15-8-7-14(10-22)16(21)9-15/h3-9,13H,11-12H2,1-2H3,(H,23,26)