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

Systemtic Name: N-tert-butyl-4-[[4-chloranyl-6-[4-(2-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-tert-butyl-4-[[4-chloro-6-[4-(2-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-tert-butyl-4-[[[4-chloro-6-[4-(2-chlorophenyl)-1-piperazinyl]-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-tert-butyl-4-[[4-chloro-6-[4-(2-chlorophenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-tert-butyl-4-[[[4-chloro-6-[4-(2-chlorophenyl)piperazino]pyrimidin-2-yl]thio]methyl]benzamide Formula: C26H29Cl2N5OS MolecularWeight: 530.51236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)Cl)N3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)Cl)N3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H29Cl2N5OS/c1-26(2,3)31-24(34)19-10-8-18(9-11-19)17-35-25-29-22(28)16-23(30-25)33-14-12-32(13-15-33)21-7-5-4-6-20(21)27/h4-11,16H,12-15,17H2,1-3H3,(H,31,34)