N-[4-[1-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylethyl]phenyl]methanamide

Systemtic Name: N-[4-[1-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylethyl]phenyl]methanamide Openeye Name: N-[4-[1-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylethyl]phenyl]formamide CAS Name: N-[4-[1-[[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]thio]ethyl]phenyl]formamide IUPAC Name: N-[4-[1-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]sulfanylethyl]phenyl]formamide Traditional Name: N-[4-[1-[[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propyl]thio]ethyl]phenyl]formamide Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN3OS/c1-17(19-5-9-21(10-6-19)25-16-27)28-22(14-26-13-12-24-15-26)11-4-18-2-7-20(23)8-3-18/h2-3,5-10,12-13,15-17,22H,4,11,14H2,1H3,(H,25,27)