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

Systemtic Name: N-[4-(2-methylpropanoylamino)phenyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(2-methylpropanoylamino)phenyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(2-methylpropanoylamino)phenyl]-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(isobutyrylamino)phenyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C23H26F3N3O4S MolecularWeight: 497.53045

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C23H26F3N3O4S/c1-15(2)21(30)27-17-7-9-18(10-8-17)28-22(31)16-11-13-29(14-12-16)34(32,33)20-6-4-3-5-19(20)23(24,25)26/h3-10,15-16H,11-14H2,1-2H3,(H,27,30)(H,28,31)