[5-chloranyl-2-(phenylmethyl)sulfonyl-pyrimidin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [5-chloranyl-2-(phenylmethyl)sulfonyl-pyrimidin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (2-benzylsulfonyl-5-chloro-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-chloro-2-(phenylmethyl)sulfonyl-4-pyrimidinyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: (2-benzylsulfonyl-5-chloropyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: (2-benzylsulfonyl-5-chloro-pyrimidin-4-yl)-[4-(2-methoxyphenyl)piperazino]methanone Formula: C23H23ClN4O4S MolecularWeight: 486.97112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H23ClN4O4S/c1-32-20-10-6-5-9-19(20)27-11-13-28(14-12-27)22(29)21-18(24)15-25-23(26-21)33(30,31)16-17-7-3-2-4-8-17/h2-10,15H,11-14,16H2,1H3