(4-azanylquinazolin-2-yl)methyl 2-(2,5-dimethylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-(2,5-dimethylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(2,5-dimethylphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2,5-dimethylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2,5-dimethylphenyl)-1,3-diketo-isoindoline-5-carboxylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C26H20N4O4 MolecularWeight: 452.4614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C26H20N4O4/c1-14-7-8-15(2)21(11-14)30-24(31)17-10-9-16(12-19(17)25(30)32)26(33)34-13-22-28-20-6-4-3-5-18(20)23(27)29-22/h3-12H,13H2,1-2H3,(H2,27,28,29)