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

Systemtic Name: ethyl 6-(2,5-dimethoxyphenyl)-3-ethyl-4-[(3-methylpiperazin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(2,5-dimethoxyphenyl)-3-ethyl-4-[(3-methylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2,5-dimethoxyphenyl)-3-ethyl-4-[(3-methyl-1-piperazinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2,5-dimethoxyphenyl)-3-ethyl-4-[(3-methylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2,5-dimethoxyphenyl)-3-ethyl-2-keto-4-[(3-methylpiperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H34N4O5 MolecularWeight: 446.53986

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=C(C=CC(=C2)OC)OC)C(=O)OCC)CN3CCNC(C3)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=C(C=CC(=C2)OC)OC)C(=O)OCC)CN3CCNC(C3)C

InChI

InChI=1S/C23H34N4O5/c1-6-27-18(14-26-11-10-24-15(3)13-26)20(22(28)32-7-2)21(25-23(27)29)17-12-16(30-4)8-9-19(17)31-5/h8-9,12,15,21,24H,6-7,10-11,13-14H2,1-5H3,(H,25,29)