(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfonyl-pyrimidin-4-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone CAS Name: (5-chloro-2-methylsulfonyl-4-pyrimidinyl)-[4-(3-chlorophenyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methylsulfonylpyrimidin-4-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone Traditional Name: (5-chloro-2-mesyl-pyrimidin-4-yl)-[4-(3-chlorophenyl)piperazino]methanone Formula: C16H16Cl2N4O3S MolecularWeight: 415.29424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)Cl

InChI

InChI=1S/C16H16Cl2N4O3S/c1-26(24,25)16-19-10-13(18)14(20-16)15(23)22-7-5-21(6-8-22)12-4-2-3-11(17)9-12/h2-4,9-10H,5-8H2,1H3