N-[(1S)-1-[3,4-bis(fluoranyl)phenyl]ethyl]-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-[3,4-bis(fluoranyl)phenyl]ethyl]-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-(3,4-difluorophenyl)ethyl]-N-methyl-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(1S)-1-(3,4-difluorophenyl)ethyl]-N-methyl-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(1S)-1-(3,4-difluorophenyl)ethyl]-N-methyl-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-1-(3,4-difluorophenyl)ethyl]-N-methyl-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H23F2N3O3S MolecularWeight: 423.476726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)F)N(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H23F2N3O3S/c1-14(16-5-6-18(21)19(22)12-16)24(2)20(26)15-7-10-25(11-8-15)29(27,28)17-4-3-9-23-13-17/h3-6,9,12-15H,7-8,10-11H2,1-2H3/t14-/m0/s1