ethyl 6-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carbonyl)oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[4-cyano-2-methyl-5-(1-pyrrolyl)-3-furanyl]-oxomethoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carbonyl)oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(4-cyano-2-methyl-5-pyrrol-1-yl-3-furoyl)oxymethyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H22N4O6 MolecularWeight: 426.42258

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C)C(=O)OCC

Isomeric SMILES

CCC1C(=C(NC(=O)N1)COC(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C)C(=O)OCC

InChI

InChI=1S/C21H22N4O6/c1-4-14-17(20(27)29-5-2)15(24-21(28)23-14)11-30-19(26)16-12(3)31-18(13(16)10-22)25-8-6-7-9-25/h6-9,14H,4-5,11H2,1-3H3,(H2,23,24,28)