N-[3,4-bis(fluoranyl)phenyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3,4-difluorophenyl)-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3,4-difluorophenyl)-1-[(1-methyl-3-pyrrolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3,4-difluorophenyl)-1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3,4-difluorophenyl)-1-(1-methylpyrrol-3-yl)sulfonyl-isonipecotamide Formula: C17H19F2N3O3S MolecularWeight: 383.412866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)F

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C17H19F2N3O3S/c1-21-7-6-14(11-21)26(24,25)22-8-4-12(5-9-22)17(23)20-13-2-3-15(18)16(19)10-13/h2-3,6-7,10-12H,4-5,8-9H2,1H3,(H,20,23)