ethyl 3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-6-(2-methylphenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-6-(2-methylphenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-6-(o-tolyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-4-[(4-ethyl-1-piperazinyl)methyl]-6-(2-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-6-(2-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-4-[(4-ethylpiperazino)methyl]-2-keto-6-(o-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H34N4O3 MolecularWeight: 414.54106

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=CC=CC=C3C)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=CC=CC=C3C)C(=O)OCC

InChI

InChI=1S/C23H34N4O3/c1-5-25-12-14-26(15-13-25)16-19-20(22(28)30-7-3)21(24-23(29)27(19)6-2)18-11-9-8-10-17(18)4/h8-11,21H,5-7,12-16H2,1-4H3,(H,24,29)