2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-oxidanylidene-imidazol-4-yl]-1-methoxy-ethenolate

Systemtic Name: 2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-oxidanylidene-imidazol-4-yl]-1-methoxy-ethenolate Openeye Name: 2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-oxo-imidazol-4-yl]-1-methoxy-ethenolate CAS Name: 2-[2-[(4,6-dimethyl-2-quinazolinyl)amino]-5-oxo-4-imidazolyl]-1-methoxyethenolate IUPAC Name: 2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-oxoimidazol-4-yl]-1-methoxyethenolate Traditional Name: 2-[2-[(4,6-dimethylquinazolin-2-yl)amino]-5-keto-imidazol-4-yl]-1-methoxy-ethenolate Formula: C16H14N5O3- MolecularWeight: 324.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C(=N3)C=C([O-])OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C(=N3)C=C([O-])OC

InChI

InChI=1S/C16H15N5O3/c1-8-4-5-11-10(6-8)9(2)17-15(18-11)21-16-19-12(14(23)20-16)7-13(22)24-3/h4-7,22H,1-3H3,(H,17,18,20,21,23)/p-1