N-(2,3-dimethylcyclohexyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C21H29F3N2O3S MolecularWeight: 446.52677

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H29F3N2O3S/c1-14-5-3-8-19(15(14)2)25-20(27)16-9-11-26(12-10-16)30(28,29)18-7-4-6-17(13-18)21(22,23)24/h4,6-7,13-16,19H,3,5,8-12H2,1-2H3,(H,25,27)