ethyl 2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2-methylphenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2-methylphenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(o-tolyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2-methylphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-keto-4-(o-tolyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4C

InChI

InChI=1S/C23H25N3O3/c1-3-29-22(28)19-20(18-11-7-4-8-15(18)2)24-23(25-21(19)27)26-13-12-16-9-5-6-10-17(16)14-26/h4-11,19-20H,3,12-14H2,1-2H3,(H,24,25,27)