N-(3-acetamido-4-fluoranyl-phenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-1-(benzenesulfonyl)piperidine-3-carboxamide CAS Name: N-(3-acetamido-4-fluorophenyl)-1-(benzenesulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-1-(benzenesulfonyl)piperidine-3-carboxamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-1-besyl-nipecotamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3)F

InChI

InChI=1S/C20H22FN3O4S/c1-14(25)22-19-12-16(9-10-18(19)21)23-20(26)15-6-5-11-24(13-15)29(27,28)17-7-3-2-4-8-17/h2-4,7-10,12,15H,5-6,11,13H2,1H3,(H,22,25)(H,23,26)