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

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-fluoro-4-methyl-benzyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C19H22FN3O3S MolecularWeight: 391.459683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)F

InChI

InChI=1S/C19H22FN3O3S/c1-14-4-5-15(11-18(14)20)12-22-19(24)16-6-9-23(10-7-16)27(25,26)17-3-2-8-21-13-17/h2-5,8,11,13,16H,6-7,9-10,12H2,1H3,(H,22,24)