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

Systemtic Name: N-[3-[(3-cyano-6-ethoxy-quinolin-2-yl)amino]propyl]benzenesulfonamide Openeye Name: N-[3-[(3-cyano-6-ethoxy-2-quinolyl)amino]propyl]benzenesulfonamide CAS Name: N-[3-[(3-cyano-6-ethoxy-2-quinolinyl)amino]propyl]benzenesulfonamide IUPAC Name: N-[3-[(3-cyano-6-ethoxyquinolin-2-yl)amino]propyl]benzenesulfonamide Traditional Name: N-[3-[(3-cyano-6-ethoxy-2-quinolyl)amino]propyl]benzenesulfonamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3S/c1-2-28-18-9-10-20-16(14-18)13-17(15-22)21(25-20)23-11-6-12-24-29(26,27)19-7-4-3-5-8-19/h3-5,7-10,13-14,24H,2,6,11-12H2,1H3,(H,23,25)