2-[[6-bromanyl-4-(4-butylphenyl)quinazolin-2-yl]amino]benzenesulfonamide

Systemtic Name: 2-[[6-bromanyl-4-(4-butylphenyl)quinazolin-2-yl]amino]benzenesulfonamide Openeye Name: 2-[[6-bromo-4-(4-butylphenyl)quinazolin-2-yl]amino]benzenesulfonamide CAS Name: 2-[[6-bromo-4-(4-butylphenyl)-2-quinazolinyl]amino]benzenesulfonamide IUPAC Name: 2-[[6-bromo-4-(4-butylphenyl)quinazolin-2-yl]amino]benzenesulfonamide Traditional Name: 2-[[6-bromo-4-(4-butylphenyl)quinazolin-2-yl]amino]benzenesulfonamide Formula: C24H23BrN4O2S MolecularWeight: 511.43402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C24H23BrN4O2S/c1-2-3-6-16-9-11-17(12-10-16)23-19-15-18(25)13-14-20(19)27-24(29-23)28-21-7-4-5-8-22(21)32(26,30)31/h4-5,7-15H,2-3,6H2,1H3,(H2,26,30,31)(H,27,28,29)