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

Systemtic Name: (5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfonyl-pyrimidin-4-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone CAS Name: (5-chloro-2-methylsulfonyl-4-pyrimidinyl)-[4-(2-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methylsulfonylpyrimidin-4-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone Traditional Name: (5-chloro-2-mesyl-pyrimidin-4-yl)-[4-(2-fluorophenyl)piperazino]methanone Formula: C16H16ClFN4O3S MolecularWeight: 398.839643

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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=C3F)Cl

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCN(CC2)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C16H16ClFN4O3S/c1-26(24,25)16-19-10-11(17)14(20-16)15(23)22-8-6-21(7-9-22)13-5-3-2-4-12(13)18/h2-5,10H,6-9H2,1H3