N-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanyl-2-methyl-phenyl]ethanamide

Systemtic Name: N-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanyl-2-methyl-phenyl]ethanamide Openeye Name: N-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propyl]sulfanyl-2-methyl-phenyl]acetamide CAS Name: N-[4-[[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]thio]-2-methylphenyl]acetamide IUPAC Name: N-[4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]sulfanyl-2-methylphenyl]acetamide Traditional Name: N-[4-[[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propyl]thio]-2-methyl-phenyl]acetamide Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)SC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)NC(=O)C

InChI

InChI=1S/C22H24ClN3OS/c1-16-13-20(9-10-22(16)25-17(2)27)28-21(14-26-12-11-24-15-26)8-5-18-3-6-19(23)7-4-18/h3-4,6-7,9-13,15,21H,5,8,14H2,1-2H3,(H,25,27)