2-[(3-bromanyl-6-oxidanylidene-pyrimido[2,1-b]quinazolin-2-yl)amino]-N-phenyl-benzamide chloride

Systemtic Name: 2-[(3-bromanyl-6-oxidanylidene-pyrimido[2,1-b]quinazolin-2-yl)amino]-N-phenyl-benzamide chloride Openeye Name: 2-[(3-bromo-6-oxo-pyrimido[2,1-b]quinazolin-2-yl)amino]-N-phenyl-benzamide chloride CAS Name: 2-[(3-bromo-6-oxo-2-pyrimido[2,1-b]quinazolinyl)amino]-N-phenylbenzamide chloride IUPAC Name: 2-[(3-bromo-6-oxopyrimido[2,1-b]quinazolin-2-yl)amino]-N-phenylbenzamide chloride Traditional Name: 2-[(3-bromo-6-keto-pyrimido[2,1-b]quinazolin-2-yl)amino]-N-phenyl-benzamide chloride Formula: C24H16BrClN5O2- MolecularWeight: 521.77314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC3=NC4=NC5=CC=CC=C5C(=O)N4C=C3Br.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC3=NC4=NC5=CC=CC=C5C(=O)N4C=C3Br.[Cl-]

InChI

InChI=1S/C24H16BrN5O2.ClH/c25-18-14-30-23(32)17-11-5-7-13-20(17)28-24(30)29-21(18)27-19-12-6-4-10-16(19)22(31)26-15-8-2-1-3-9-15;/h1-14H,(H,26,31)(H,27,28,29);1H/p-1