1-[(4-fluorophenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-(m-tolylmethyl)piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-fluorophenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzyl)sulfonyl-N-(3-methylbenzyl)isonipecotamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O3S/c1-16-3-2-4-18(13-16)14-23-21(25)19-9-11-24(12-10-19)28(26,27)15-17-5-7-20(22)8-6-17/h2-8,13,19H,9-12,14-15H2,1H3,(H,23,25)