(3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine

Systemtic Name: (3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine Openeye Name: (3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine CAS Name: (3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine IUPAC Name: (3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine Traditional Name: (3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine Formula: C16H18F3N3O2S MolecularWeight: 373.39323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN=C1)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=C(NN=C1)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C16H18F3N3O2S/c1-11-9-20-21-15(11)12-5-4-8-22(10-12)25(23,24)14-7-3-2-6-13(14)16(17,18)19/h2-3,6-7,9,12H,4-5,8,10H2,1H3,(H,20,21)/t12-/m0/s1