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

Systemtic Name: 4-[2-[[6-bromanyl-2-(trifluoromethyl)quinazolin-4-yl]amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[[6-bromo-2-(trifluoromethyl)-4-quinazolinyl]amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]ethyl]benzenesulfonamide Formula: C17H14BrF3N4O2S MolecularWeight: 475.28287

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC2=NC(=NC3=C2C=C(C=C3)Br)C(F)(F)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC2=NC(=NC3=C2C=C(C=C3)Br)C(F)(F)F)S(=O)(=O)N

InChI

InChI=1S/C17H14BrF3N4O2S/c18-11-3-6-14-13(9-11)15(25-16(24-14)17(19,20)21)23-8-7-10-1-4-12(5-2-10)28(22,26)27/h1-6,9H,7-8H2,(H2,22,26,27)(H,23,24,25)