N-[3-[(3-cyano-7-methyl-quinolin-2-yl)amino]propyl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(3-cyano-7-methyl-quinolin-2-yl)amino]propyl]-2-fluoranyl-benzenesulfonamide Openeye Name: N-[3-[(3-cyano-7-methyl-2-quinolyl)amino]propyl]-2-fluoro-benzenesulfonamide CAS Name: N-[3-[(3-cyano-7-methyl-2-quinolinyl)amino]propyl]-2-fluorobenzenesulfonamide IUPAC Name: N-[3-[(3-cyano-7-methylquinolin-2-yl)amino]propyl]-2-fluorobenzenesulfonamide Traditional Name: N-[3-[(3-cyano-7-methyl-2-quinolyl)amino]propyl]-2-fluoro-benzenesulfonamide Formula: C20H19FN4O2S MolecularWeight: 398.453863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)NCCCNS(=O)(=O)C3=CC=CC=C3F)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)NCCCNS(=O)(=O)C3=CC=CC=C3F)C#N

InChI

InChI=1S/C20H19FN4O2S/c1-14-7-8-15-12-16(13-22)20(25-18(15)11-14)23-9-4-10-24-28(26,27)19-6-3-2-5-17(19)21/h2-3,5-8,11-12,24H,4,9-10H2,1H3,(H,23,25)