8-[4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperidin-1-yl]sulfonylquinoline

Systemtic Name: 8-[4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperidin-1-yl]sulfonylquinoline Openeye Name: 8-[[4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-1-piperidyl]sulfonyl]quinoline CAS Name: 8-[[4-[5-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1-piperidinyl]sulfonyl]quinoline IUPAC Name: 8-[4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperidin-1-yl]sulfonylquinoline Traditional Name: 8-[4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperidino]sulfonylquinoline Formula: C25H21F3N4O2S MolecularWeight: 498.52005

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=NC=C2C3=CC(=CC=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC=NC=C2C3=CC(=CC=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H21F3N4O2S/c26-25(27,28)20-7-1-5-19(14-20)21-15-29-16-31-23(21)18-9-12-32(13-10-18)35(33,34)22-8-2-4-17-6-3-11-30-24(17)22/h1-8,11,14-16,18H,9-10,12-13H2