methyl 2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(2,4-dimethylbenzyl)-methyl-amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C21H23N3O3/c1-13-5-6-16(14(2)9-13)11-24(3)12-19-22-18-10-15(21(26)27-4)7-8-17(18)20(25)23-19/h5-10H,11-12H2,1-4H3,(H,22,23,25)