N-[3-[(3-cyano-6-ethoxy-quinolin-2-yl)amino]propyl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(3-cyano-6-ethoxy-quinolin-2-yl)amino]propyl]-2-fluoranyl-benzenesulfonamide Openeye Name: N-[3-[(3-cyano-6-ethoxy-2-quinolyl)amino]propyl]-2-fluoro-benzenesulfonamide CAS Name: N-[3-[(3-cyano-6-ethoxy-2-quinolinyl)amino]propyl]-2-fluorobenzenesulfonamide IUPAC Name: N-[3-[(3-cyano-6-ethoxyquinolin-2-yl)amino]propyl]-2-fluorobenzenesulfonamide Traditional Name: N-[3-[(3-cyano-6-ethoxy-2-quinolyl)amino]propyl]-2-fluoro-benzenesulfonamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)NCCCNS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)NCCCNS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H21FN4O3S/c1-2-29-17-8-9-19-15(13-17)12-16(14-23)21(26-19)24-10-5-11-25-30(27,28)20-7-4-3-6-18(20)22/h3-4,6-9,12-13,25H,2,5,10-11H2,1H3,(H,24,26)