ethyl 6-[[4-bromanyl-1-(2-fluorophenyl)pyrazol-3-yl]carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[4-bromanyl-1-(2-fluorophenyl)pyrazol-3-yl]carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[4-bromo-1-(2-fluorophenyl)pyrazole-3-carbonyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[4-bromo-1-(2-fluorophenyl)-3-pyrazolyl]-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[4-bromo-1-(2-fluorophenyl)pyrazole-3-carbonyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[4-bromo-1-(2-fluorophenyl)pyrazole-3-carbonyl]oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H16BrFN4O5 MolecularWeight: 467.245843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2=NN(C=C2Br)C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2=NN(C=C2Br)C3=CC=CC=C3F

InChI

InChI=1S/C18H16BrFN4O5/c1-2-28-16(25)10-7-21-18(27)22-13(10)9-29-17(26)15-11(19)8-24(23-15)14-6-4-3-5-12(14)20/h3-6,8H,2,7,9H2,1H3,(H2,21,22,27)