propyl 2-[(3-methyl-6-oxidanylidene-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate chloride

Systemtic Name: propyl 2-[(3-methyl-6-oxidanylidene-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate chloride Openeye Name: propyl 2-[(3-methyl-6-oxo-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoate chloride CAS Name: 2-[(3-methyl-6-oxo-2-pyrimido[2,1-b]quinazolinyl)amino]benzoic acid propyl ester chloride IUPAC Name: propyl 2-[(3-methyl-6-oxopyrimido[2,1-b]quinazolin-2-yl)amino]benzoate chloride Traditional Name: 2-[(6-keto-3-methyl-pyrimido[2,1-b]quinazolin-2-yl)amino]benzoic acid propyl ester chloride Formula: C22H20ClN4O3- MolecularWeight: 423.8722

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=CC=C1NC2=NC3=NC4=CC=CC=C4C(=O)N3C=C2C.[Cl-]

Isomeric SMILES

CCCOC(=O)C1=CC=CC=C1NC2=NC3=NC4=CC=CC=C4C(=O)N3C=C2C.[Cl-]

InChI

InChI=1S/C22H20N4O3.ClH/c1-3-12-29-21(28)16-9-5-7-11-18(16)23-19-14(2)13-26-20(27)15-8-4-6-10-17(15)24-22(26)25-19;/h4-11,13H,3,12H2,1-2H3,(H,23,24,25);1H/p-1