(5-methylsulfonyl-2-pyridin-4-yl-phenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (5-methylsulfonyl-2-pyridin-4-yl-phenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: [5-methylsulfonyl-2-(4-pyridyl)phenyl]-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-methylsulfonyl-2-pyridin-4-ylphenyl)-[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-methylsulfonyl-2-pyridin-4-ylphenyl)-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [5-mesyl-2-(4-pyridyl)phenyl]-[4-[4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C24H22F3N3O3S MolecularWeight: 489.50999

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C2=CC=NC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C2=CC=NC=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C24H22F3N3O3S/c1-34(32,33)20-6-7-21(17-8-10-28-11-9-17)22(16-20)23(31)30-14-12-29(13-15-30)19-4-2-18(3-5-19)24(25,26)27/h2-11,16H,12-15H2,1H3