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

Systemtic Name: N-[(2S)-2-phenylpropyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(2S)-2-phenylpropyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[(2S)-2-phenylpropyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-2-phenylpropyl]-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[(2S)-2-phenylpropyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C22H25F3N2O3S MolecularWeight: 454.50571

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C22H25F3N2O3S/c1-16(17-7-3-2-4-8-17)15-26-21(28)18-11-13-27(14-12-18)31(29,30)20-10-6-5-9-19(20)22(23,24)25/h2-10,16,18H,11-15H2,1H3,(H,26,28)/t16-/m1/s1