N-[2-(2-methylpropanoylamino)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(2-methylpropanoylamino)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(2-methylpropanoylamino)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C19H26F3N3O4S MolecularWeight: 449.48765

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H26F3N3O4S/c1-13(2)17(26)23-8-9-24-18(27)14-6-10-25(11-7-14)30(28,29)16-5-3-4-15(12-16)19(20,21)22/h3-5,12-14H,6-11H2,1-2H3,(H,23,26)(H,24,27)