N-[(2,5-dimethylphenyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[(2,5-dimethylphenyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-[(2,5-dimethylphenyl)methyl]-1-(4-fluorophenyl)sulfonyl-piperidine-2-carboxamide CAS Name: N-[(2,5-dimethylphenyl)methyl]-1-(4-fluorophenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: N-[(2,5-dimethylphenyl)methyl]-1-(4-fluorophenyl)sulfonylpiperidine-2-carboxamide Traditional Name: N-(2,5-dimethylbenzyl)-1-(4-fluorophenyl)sulfonyl-pipecolinamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O3S/c1-15-6-7-16(2)17(13-15)14-23-21(25)20-5-3-4-12-24(20)28(26,27)19-10-8-18(22)9-11-19/h6-11,13,20H,3-5,12,14H2,1-2H3,(H,23,25)