methyl 2-[2-[(4-methylquinazolin-2-yl)amino]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(4-methylquinazolin-2-yl)amino]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(4-methylquinazolin-2-yl)amino]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[(4-methyl-2-quinazolinyl)amino]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-methylquinazolin-2-yl)amino]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[(4-methylquinazolin-2-yl)amino]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CC(=O)OC

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CC(=O)OC

InChI

InChI=1S/C16H15N5O3/c1-9-11-5-3-4-6-12(11)19-15(17-9)21-16-18-10(7-13(22)20-16)8-14(23)24-2/h3-7H,8H2,1-2H3,(H2,17,18,19,20,21,22)