N-(4-acetamidophenyl)-1-[2,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-[2,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-(2,5-difluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-acetamidophenyl)-1-(2,5-difluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-(2,5-difluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-(2,5-difluorophenyl)sulfonyl-isonipecotamide Formula: C20H21F2N3O4S MolecularWeight: 437.460246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C20H21F2N3O4S/c1-13(26)23-16-3-5-17(6-4-16)24-20(27)14-8-10-25(11-9-14)30(28,29)19-12-15(21)2-7-18(19)22/h2-7,12,14H,8-11H2,1H3,(H,23,26)(H,24,27)