3-[[4-chloranyl-6-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(4-methylphenyl)benzamide

Systemtic Name: 3-[[4-chloranyl-6-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(4-methylphenyl)benzamide Openeye Name: 3-[[4-chloro-6-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(p-tolyl)benzamide CAS Name: 3-[[[4-chloro-6-[4-(3-chlorophenyl)-1-piperazinyl]-2-pyrimidinyl]thio]methyl]-N-(4-methylphenyl)benzamide IUPAC Name: 3-[[4-chloro-6-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]-N-(4-methylphenyl)benzamide Traditional Name: 3-[[[4-chloro-6-[4-(3-chlorophenyl)piperazino]pyrimidin-2-yl]thio]methyl]-N-(p-tolyl)benzamide Formula: C29H27Cl2N5OS MolecularWeight: 564.52858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC3=NC(=CC(=N3)Cl)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CSC3=NC(=CC(=N3)Cl)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H27Cl2N5OS/c1-20-8-10-24(11-9-20)32-28(37)22-5-2-4-21(16-22)19-38-29-33-26(31)18-27(34-29)36-14-12-35(13-15-36)25-7-3-6-23(30)17-25/h2-11,16-18H,12-15,19H2,1H3,(H,32,37)