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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C20H21F2N3O4S/c21-16-5-6-17(22)18(11-16)30(28,29)25-9-7-15(8-10-25)20(27)24-12-13-1-3-14(4-2-13)19(23)26/h1-6,11,15H,7-10,12H2,(H2,23,26)(H,24,27)