1-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-(6-chloranylquinolin-8-yl)piperidine-4-carboxamide

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-(6-chloranylquinolin-8-yl)piperidine-4-carboxamide Openeye Name: N-(6-chloro-8-quinolyl)-1-(3,4-difluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(6-chloro-8-quinolinyl)-1-(3,4-difluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-chloroquinolin-8-yl)-1-(3,4-difluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(6-chloro-8-quinolyl)-1-(3,4-difluorophenyl)sulfonyl-isonipecotamide Formula: C21H18ClF2N3O3S MolecularWeight: 465.900726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C3C(=CC(=C2)Cl)C=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C3C(=CC(=C2)Cl)C=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C21H18ClF2N3O3S/c22-15-10-14-2-1-7-25-20(14)19(11-15)26-21(28)13-5-8-27(9-6-13)31(29,30)16-3-4-17(23)18(24)12-16/h1-4,7,10-13H,5-6,8-9H2,(H,26,28)