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

Systemtic Name: ethyl 2-(4-methanoylpiperazin-1-yl)-6-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-formylpiperazin-1-yl)-6-oxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-(4-formyl-1-piperazinyl)-6-oxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-formylpiperazin-1-yl)-6-oxo-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-(4-formylpiperazino)-6-keto-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H28N4O7 MolecularWeight: 448.46962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H28N4O7/c1-5-32-20(28)16-17(13-10-14(29-2)18(31-4)15(11-13)30-3)22-21(23-19(16)27)25-8-6-24(12-26)7-9-25/h10-12,16-17H,5-9H2,1-4H3,(H,22,23,27)