N-(3-methylbutan-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-methylbutan-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,2-dimethylpropyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-methylbutan-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-methylbutan-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,2-dimethylpropyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C18H25F3N2O3S MolecularWeight: 406.46291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC(C)C(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C18H25F3N2O3S/c1-12(2)13(3)22-17(24)14-8-10-23(11-9-14)27(25,26)16-7-5-4-6-15(16)18(19,20)21/h4-7,12-14H,8-11H2,1-3H3,(H,22,24)