6-[(4-bromophenyl)-methyl-sulfamoyl]-N-butan-2-yl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-[(4-bromophenyl)-methyl-sulfamoyl]-N-butan-2-yl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-[(4-bromophenyl)-methyl-sulfamoyl]-4-oxo-N-sec-butyl-1H-quinoline-3-carboxamide CAS Name: 6-[(4-bromophenyl)-methylsulfamoyl]-N-butan-2-yl-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-[(4-bromophenyl)-methylsulfamoyl]-N-butan-2-yl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-[(4-bromophenyl)-methyl-sulfamoyl]-4-keto-N-sec-butyl-1H-quinoline-3-carboxamide Formula: C21H22BrN3O4S MolecularWeight: 492.38608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N(C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C)NC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N(C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O4S/c1-4-13(2)24-21(27)18-12-23-19-10-9-16(11-17(19)20(18)26)30(28,29)25(3)15-7-5-14(22)6-8-15/h5-13H,4H2,1-3H3,(H,23,26)(H,24,27)