ethyl 6-[[2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-piperazin-1-yl]methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[2-(2-methoxy-2-oxo-ethyl)-3-oxo-piperazin-1-yl]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[2-(2-methoxy-2-oxoethyl)-3-oxo-1-piperazinyl]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-(2-methoxy-2-oxoethyl)-3-oxopiperazin-1-yl]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[3-keto-2-(2-keto-2-methoxy-ethyl)piperazino]methyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H26N4O6 MolecularWeight: 430.45434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN3CCNC(=O)C3CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN3CCNC(=O)C3CC(=O)OC

InChI

InChI=1S/C21H26N4O6/c1-3-31-20(28)17-14(23-21(29)24-18(17)13-7-5-4-6-8-13)12-25-10-9-22-19(27)15(25)11-16(26)30-2/h4-8,15,18H,3,9-12H2,1-2H3,(H,22,27)(H2,23,24,29)