N-[(4-fluoranyl-3-methyl-phenyl)methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H22F2N2O3S MolecularWeight: 408.462086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)F

InChI

InChI=1S/C20H22F2N2O3S/c1-14-12-15(6-7-17(14)21)13-23-20(25)16-8-10-24(11-9-16)28(26,27)19-5-3-2-4-18(19)22/h2-7,12,16H,8-11,13H2,1H3,(H,23,25)