[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoate

Systemtic Name: [2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoate Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] 2-(8-methyl-4-oxo-quinazolin-3-yl)acetate CAS Name: 2-(8-methyl-4-oxo-3-quinazolinyl)acetic acid [2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] 2-(8-methyl-4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-keto-8-methyl-quinazolin-3-yl)acetic acid [2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)OC(=O)CN3C=NC4=C(C3=O)C=CC=C4C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)OC(=O)CN3C=NC4=C(C3=O)C=CC=C4C

InChI

InChI=1S/C27H25N3O4/c1-17-12-13-18(2)22(14-17)29-26(32)25(20-9-5-4-6-10-20)34-23(31)15-30-16-28-24-19(3)8-7-11-21(24)27(30)33/h4-14,16,25H,15H2,1-3H3,(H,29,32)