4-[(4-chlorophenyl)sulfanylmethyl]-N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[(S)-(1-methyl-2-imidazolyl)-phenylmethyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(S)-(1-methylimidazol-2-yl)-phenylmethyl]benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[(S)-(1-methylimidazol-2-yl)-phenyl-methyl]benzamide Formula: C25H22ClN3OS MolecularWeight: 447.97968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C=CN=C1[C@H](C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN3OS/c1-29-16-15-27-24(29)23(19-5-3-2-4-6-19)28-25(30)20-9-7-18(8-10-20)17-31-22-13-11-21(26)12-14-22/h2-16,23H,17H2,1H3,(H,28,30)/t23-/m0/s1