2-[[6-bromanyl-3-(4-chlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[6-bromanyl-3-(4-chlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazolin-4-yl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-keto-1H-quinazoline-4-carbonyl]amino]ethyl-diethyl-ammonium Formula: C21H25BrClN4O3+ MolecularWeight: 496.8052

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1(C2=C(C=CC(=C2)Br)NC(=O)N1C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1(C2=C(C=CC(=C2)Br)NC(=O)N1C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C21H24BrClN4O3/c1-3-26(4-2)12-11-24-19(28)21(30)17-13-14(22)5-10-18(17)25-20(29)27(21)16-8-6-15(23)7-9-16/h5-10,13,30H,3-4,11-12H2,1-2H3,(H,24,28)(H,25,29)/p+1