N-[2-[(3-cyano-8-methyl-quinolin-2-yl)amino]ethyl]-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-[(3-cyano-8-methyl-quinolin-2-yl)amino]ethyl]-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-[(3-cyano-8-methyl-2-quinolyl)amino]ethyl]-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-[(3-cyano-8-methyl-2-quinolinyl)amino]ethyl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-[(3-cyano-8-methylquinolin-2-yl)amino]ethyl]-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-[(3-cyano-8-methyl-2-quinolyl)amino]ethyl]-4-(trifluoromethyl)benzenesulfonamide Formula: C20H17F3N4O2S MolecularWeight: 434.43479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C(=C2)C#N)NCCNS(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1N=C(C(=C2)C#N)NCCNS(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H17F3N4O2S/c1-13-3-2-4-14-11-15(12-24)19(27-18(13)14)25-9-10-26-30(28,29)17-7-5-16(6-8-17)20(21,22)23/h2-8,11,26H,9-10H2,1H3,(H,25,27)