N-butan-2-yl-4-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzenesulfonamide

Systemtic Name: N-butan-2-yl-4-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzenesulfonamide Openeye Name: 4-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]-N-sec-butyl-benzenesulfonamide CAS Name: N-butan-2-yl-4-[[2-methyl-7-(trifluoromethyl)-4-quinolinyl]amino]benzenesulfonamide IUPAC Name: N-butan-2-yl-4-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzenesulfonamide Traditional Name: 4-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]-N-sec-butyl-benzenesulfonamide Formula: C21H22F3N3O2S MolecularWeight: 437.47849

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C2C=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C2C=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C21H22F3N3O2S/c1-4-13(2)27-30(28,29)17-8-6-16(7-9-17)26-19-11-14(3)25-20-12-15(21(22,23)24)5-10-18(19)20/h5-13,27H,4H2,1-3H3,(H,25,26)