(4-pyrimidin-2-ylpiperazin-1-yl)-[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]methanone Formula: C21H24F3N5O3S MolecularWeight: 483.50717

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H24F3N5O3S/c22-21(23,24)17-3-1-4-18(15-17)33(31,32)29-9-5-16(6-10-29)19(30)27-11-13-28(14-12-27)20-25-7-2-8-26-20/h1-4,7-8,15-16H,5-6,9-14H2