1-methylsulfonyl-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-[1-[3-(trifluoromethyl)benzyl]pyrazol-4-yl]isonipecotamide Formula: C18H21F3N4O3S MolecularWeight: 430.44455

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H21F3N4O3S/c1-29(27,28)25-7-5-14(6-8-25)17(26)23-16-10-22-24(12-16)11-13-3-2-4-15(9-13)18(19,20)21/h2-4,9-10,12,14H,5-8,11H2,1H3,(H,23,26)