2-[(4-methyl-6-oxidanylidene-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate

Systemtic Name: 2-[(4-methyl-6-oxidanylidene-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate Openeye Name: 2-[(4-methyl-6-oxo-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate CAS Name: 2-[(4-methyl-6-oxo-2-pyrimido[2,1-b]quinazolinyl)amino]benzoate IUPAC Name: 2-[(4-methyl-6-oxopyrimido[2,1-b]quinazolin-2-yl)amino]benzoate Traditional Name: 2-[(6-keto-4-methyl-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate Formula: C19H13N4O3- MolecularWeight: 345.33152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC3=CC=CC=C3C(=O)N12)NC4=CC=CC=C4C(=O)[O-]

Isomeric SMILES

CC1=CC(=NC2=NC3=CC=CC=C3C(=O)N12)NC4=CC=CC=C4C(=O)[O-]

InChI

InChI=1S/C19H14N4O3/c1-11-10-16(20-15-9-5-3-7-13(15)18(25)26)22-19-21-14-8-4-2-6-12(14)17(24)23(11)19/h2-10H,1H3,(H,25,26)(H,20,21,22)/p-1