2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]-N-[4-(cyanomethyl)phenyl]acetamide Formula: C20H19ClN4OS MolecularWeight: 398.90906

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=C(C=C3)CC#N

InChI

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