2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(4-fluorophenyl)ethanamide Openeye Name: 2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide CAS Name: 2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide IUPAC Name: 2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide Traditional Name: 2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]-N-(2-cyanoethyl)-N-(4-fluorophenyl)acetamide Formula: C21H20ClFN4OS MolecularWeight: 430.926103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClFN4OS/c1-2-11-27-19-9-4-15(22)13-18(19)25-21(27)29-14-20(28)26(12-3-10-24)17-7-5-16(23)6-8-17/h4-9,13H,2-3,11-12,14H2,1H3