1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-[(1S)-1-phenylbutyl]piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(fluoranyl)phenyl]sulfonyl-N-[(1S)-1-phenylbutyl]piperidine-4-carboxamide Openeye Name: 1-(2,5-difluorophenyl)sulfonyl-N-[(1S)-1-phenylbutyl]piperidine-4-carboxamide CAS Name: 1-(2,5-difluorophenyl)sulfonyl-N-[(1S)-1-phenylbutyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,5-difluorophenyl)sulfonyl-N-[(1S)-1-phenylbutyl]piperidine-4-carboxamide Traditional Name: 1-(2,5-difluorophenyl)sulfonyl-N-[(1S)-1-phenylbutyl]isonipecotamide Formula: C22H26F2N2O3S MolecularWeight: 436.515246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C22H26F2N2O3S/c1-2-6-20(16-7-4-3-5-8-16)25-22(27)17-11-13-26(14-12-17)30(28,29)21-15-18(23)9-10-19(21)24/h3-5,7-10,15,17,20H,2,6,11-14H2,1H3,(H,25,27)/t20-/m0/s1