N-(2-chloranyl-4-methyl-phenyl)-2-[2-(3-methylbutylsulfanyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-[2-(3-methylbutylsulfanyl)benzimidazol-1-yl]ethanamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-(2-isopentylsulfanylbenzimidazol-1-yl)acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[2-(3-methylbutylthio)-1-benzimidazolyl]acetamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-[2-(3-methylbutylsulfanyl)benzimidazol-1-yl]acetamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[2-(isoamylthio)benzimidazol-1-yl]acetamide Formula: C21H24ClN3OS MolecularWeight: 401.95276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2SCCC(C)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C3=CC=CC=C3N=C2SCCC(C)C)Cl

InChI

InChI=1S/C21H24ClN3OS/c1-14(2)10-11-27-21-24-18-6-4-5-7-19(18)25(21)13-20(26)23-17-9-8-15(3)12-16(17)22/h4-9,12,14H,10-11,13H2,1-3H3,(H,23,26)