N-[2-[(3-cyano-7,8-dimethyl-quinolin-2-yl)amino]ethyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[2-[(3-cyano-7,8-dimethyl-quinolin-2-yl)amino]ethyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[2-[(3-cyano-7,8-dimethyl-2-quinolyl)amino]ethyl]-4-methoxy-benzenesulfonamide CAS Name: N-[2-[(3-cyano-7,8-dimethyl-2-quinolinyl)amino]ethyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[2-[(3-cyano-7,8-dimethylquinolin-2-yl)amino]ethyl]-4-methoxybenzenesulfonamide Traditional Name: N-[2-[(3-cyano-7,8-dimethyl-2-quinolyl)amino]ethyl]-4-methoxy-benzenesulfonamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=N2)NCCNS(=O)(=O)C3=CC=C(C=C3)OC)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=N2)NCCNS(=O)(=O)C3=CC=C(C=C3)OC)C#N)C

InChI

InChI=1S/C21H22N4O3S/c1-14-4-5-16-12-17(13-22)21(25-20(16)15(14)2)23-10-11-24-29(26,27)19-8-6-18(28-3)7-9-19/h4-9,12,24H,10-11H2,1-3H3,(H,23,25)