N-(2-chloranyl-4-fluoranyl-phenyl)-2-(2-heptylsulfanylbenzimidazol-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-(2-heptylsulfanylbenzimidazol-1-yl)ethanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-(2-heptylsulfanylbenzimidazol-1-yl)acetamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[2-(heptylthio)-1-benzimidazolyl]acetamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-(2-heptylsulfanylbenzimidazol-1-yl)acetamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[2-(heptylthio)benzimidazol-1-yl]acetamide Formula: C22H25ClFN3OS MolecularWeight: 433.969803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCCCCCCSC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H25ClFN3OS/c1-2-3-4-5-8-13-29-22-26-19-9-6-7-10-20(19)27(22)15-21(28)25-18-12-11-16(24)14-17(18)23/h6-7,9-12,14H,2-5,8,13,15H2,1H3,(H,25,28)