2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C19H15F3N4OS MolecularWeight: 404.40881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H15F3N4OS/c20-19(21,22)13-5-3-6-14(11-13)24-17(27)12-28-18-25-15-7-1-2-8-16(15)26(18)10-4-9-23/h1-3,5-8,11H,4,10,12H2,(H,24,27)