5-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)-1,3-thiazol-5-yl]-N-[4-(cyanomethyl)phenyl]pentanamide

Systemtic Name: 5-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)-1,3-thiazol-5-yl]-N-[4-(cyanomethyl)phenyl]pentanamide Openeye Name: 5-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)thiazol-5-yl]-N-[4-(cyanomethyl)phenyl]pentanamide CAS Name: 5-[2-(1-benzimidazolyl)-4-(4-chlorophenyl)-5-thiazolyl]-N-[4-(cyanomethyl)phenyl]pentanamide IUPAC Name: 5-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)-1,3-thiazol-5-yl]-N-[4-(cyanomethyl)phenyl]pentanamide Traditional Name: 5-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)thiazol-5-yl]-N-[4-(cyanomethyl)phenyl]valeramide Formula: C29H24ClN5OS MolecularWeight: 526.05176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2C3=NC(=C(S3)CCCCC(=O)NC4=CC=C(C=C4)CC#N)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2C3=NC(=C(S3)CCCCC(=O)NC4=CC=C(C=C4)CC#N)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H24ClN5OS/c30-22-13-11-21(12-14-22)28-26(37-29(34-28)35-19-32-24-5-1-2-6-25(24)35)7-3-4-8-27(36)33-23-15-9-20(10-16-23)17-18-31/h1-2,5-6,9-16,19H,3-4,7-8,17H2,(H,33,36)