methyl 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[cyclopropyl(p-tolylmethyl)amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclopropyl-[(4-methylphenyl)methyl]amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[cyclopropyl-(4-methylbenzyl)amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C4CC4

InChI

InChI=1S/C22H23N3O3/c1-14-3-5-15(6-4-14)12-25(17-8-9-17)13-20-23-19-11-16(22(27)28-2)7-10-18(19)21(26)24-20/h3-7,10-11,17H,8-9,12-13H2,1-2H3,(H,23,24,26)