N-(2-fluorophenyl)-1-(8-methoxyquinolin-5-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-fluorophenyl)-1-(8-methoxyquinolin-5-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-fluorophenyl)-1-[(8-methoxy-5-quinolyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(2-fluorophenyl)-1-[(8-methoxy-5-quinolinyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(2-fluorophenyl)-1-(8-methoxyquinolin-5-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-fluorophenyl)-1-[(8-methoxy-5-quinolyl)sulfonyl]isonipecotamide Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4F)C=CC=N2

Isomeric SMILES

COC1=C2C(=C(C=C1)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4F)C=CC=N2

InChI

InChI=1S/C22H22FN3O4S/c1-30-19-8-9-20(16-5-4-12-24-21(16)19)31(28,29)26-13-10-15(11-14-26)22(27)25-18-7-3-2-6-17(18)23/h2-9,12,15H,10-11,13-14H2,1H3,(H,25,27)