ethyl 6-(3,4-dimethoxyphenyl)-3-ethyl-2-oxidanylidene-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(3,4-dimethoxyphenyl)-3-ethyl-2-oxidanylidene-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(3,4-dimethoxyphenyl)-3-ethyl-2-oxo-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3,4-dimethoxyphenyl)-3-ethyl-2-oxo-4-(1-piperazinylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3,4-dimethoxyphenyl)-3-ethyl-2-oxo-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3,4-dimethoxyphenyl)-3-ethyl-2-keto-4-(piperazinomethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H32N4O5 MolecularWeight: 432.51328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC(=C(C=C2)OC)OC)C(=O)OCC)CN3CCNCC3

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC(=C(C=C2)OC)OC)C(=O)OCC)CN3CCNCC3

InChI

InChI=1S/C22H32N4O5/c1-5-26-16(14-25-11-9-23-10-12-25)19(21(27)31-6-2)20(24-22(26)28)15-7-8-17(29-3)18(13-15)30-4/h7-8,13,20,23H,5-6,9-12,14H2,1-4H3,(H,24,28)