(3S)-1-(4-fluorophenyl)carbonyl-N-(4-methylsulfonylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)carbonyl-N-(4-methylsulfonylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorobenzoyl)-N-(4-methylsulfonylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(4-fluorophenyl)-oxomethyl]-N-(4-methylsulfonylphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorobenzoyl)-N-(4-methylsulfonylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorobenzoyl)-N-(4-mesylphenyl)nipecotamide Formula: C20H21FN2O4S MolecularWeight: 404.455143

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O4S/c1-28(26,27)18-10-8-17(9-11-18)22-19(24)15-3-2-12-23(13-15)20(25)14-4-6-16(21)7-5-14/h4-11,15H,2-3,12-13H2,1H3,(H,22,24)/t15-/m0/s1