4-[(4-chlorophenyl)sulfanylmethyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[4-(4-methyl-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[4-(4-methylpiperazino)phenyl]benzamide Formula: C25H26ClN3OS MolecularWeight: 452.01144

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClN3OS/c1-28-14-16-29(17-15-28)23-10-8-22(9-11-23)27-25(30)20-4-2-19(3-5-20)18-31-24-12-6-21(26)7-13-24/h2-13H,14-18H2,1H3,(H,27,30)