2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[[4-chloro-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]-1-[4-(3-chlorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]-1-[4-(3-chlorophenyl)piperazino]ethanone Formula: C23H29Cl2N5OS MolecularWeight: 494.48026

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=CC(=NC(=N2)SCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)Cl

Isomeric SMILES

CN(C1CCCCC1)C2=CC(=NC(=N2)SCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)Cl

InChI

InChI=1S/C23H29Cl2N5OS/c1-28(18-7-3-2-4-8-18)21-15-20(25)26-23(27-21)32-16-22(31)30-12-10-29(11-13-30)19-9-5-6-17(24)14-19/h5-6,9,14-15,18H,2-4,7-8,10-13,16H2,1H3