ethyl 4-[[4-(butan-2-ylsulfamoyl)phenyl]amino]-7-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-[[4-(butan-2-ylsulfamoyl)phenyl]amino]-7-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-[4-(sec-butylsulfamoyl)anilino]-7-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-[4-(butan-2-ylsulfamoyl)anilino]-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(butan-2-ylsulfamoyl)anilino]-7-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-[4-(sec-butylsulfamoyl)anilino]-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C23H24F3N3O4S MolecularWeight: 495.51457

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C(=O)OCC)C(F)(F)F

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C(=O)OCC)C(F)(F)F

InChI

InChI=1S/C23H24F3N3O4S/c1-4-14(3)29-34(31,32)17-9-7-16(8-10-17)28-21-18-11-6-15(23(24,25)26)12-20(18)27-13-19(21)22(30)33-5-2/h6-14,29H,4-5H2,1-3H3,(H,27,28)