N-(3-fluoranyl-4-methoxy-phenyl)-N-propylsulfonyl-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methoxy-phenyl)-N-propylsulfonyl-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Openeye Name: N-(3-fluoro-4-methoxy-phenyl)-N-propylsulfonyl-1-[5-(trifluoromethyl)-2-pyridyl]piperidine-4-carboxamide CAS Name: N-(3-fluoro-4-methoxyphenyl)-N-propylsulfonyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-fluoro-4-methoxyphenyl)-N-propylsulfonyl-1-[5-(trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide Traditional Name: N-(3-fluoro-4-methoxy-phenyl)-N-propylsulfonyl-1-[5-(trifluoromethyl)-2-pyridyl]isonipecotamide Formula: C22H25F4N3O4S MolecularWeight: 503.510213

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H25F4N3O4S/c1-3-12-34(31,32)29(17-5-6-19(33-2)18(23)13-17)21(30)15-8-10-28(11-9-15)20-7-4-16(14-27-20)22(24,25)26/h4-7,13-15H,3,8-12H2,1-2H3