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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=CC(=NC(=N3)SCC4=CC=C(C=C4)C(=O)NCC5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=CC(=NC(=N3)SCC4=CC=C(C=C4)C(=O)NCC5=CC=CC=C5)Cl

InChI

InChI=1S/C29H27Cl2N5OS/c30-24-10-12-25(13-11-24)35-14-16-36(17-15-35)27-18-26(31)33-29(34-27)38-20-22-6-8-23(9-7-22)28(37)32-19-21-4-2-1-3-5-21/h1-13,18H,14-17,19-20H2,(H,32,37)