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

Systemtic Name: ethyl 6-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-oxo-2-[4-(2-pyridyl)piperazin-1-yl]-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-keto-2-[4-(2-pyridyl)piperazino]-4-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H31N5O6 MolecularWeight: 497.54354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C25H31N5O6/c1-5-36-24(32)20-21(16-14-17(33-2)22(35-4)18(15-16)34-3)27-25(28-23(20)31)30-12-10-29(11-13-30)19-8-6-7-9-26-19/h6-9,14-15,20-21H,5,10-13H2,1-4H3,(H,27,28,31)