ethyl 6-[(3-chloranyl-4,5-dimethoxy-phenyl)carbonyloxymethyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(3-chloranyl-4,5-dimethoxy-phenyl)carbonyloxymethyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(3-chloro-4,5-dimethoxy-benzoyl)oxymethyl]-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(3-chloro-4,5-dimethoxyphenyl)-oxomethoxy]methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(3-chloro-4,5-dimethoxybenzoyl)oxymethyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(3-chloro-4,5-dimethoxy-benzoyl)oxymethyl]-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H21ClN2O7S MolecularWeight: 480.91864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C3=CC(=C(C(=C3)Cl)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C3=CC(=C(C(=C3)Cl)OC)OC

InChI

InChI=1S/C21H21ClN2O7S/c1-4-30-20(26)16-13(23-21(27)24-17(16)15-6-5-7-32-15)10-31-19(25)11-8-12(22)18(29-3)14(9-11)28-2/h5-9,17H,4,10H2,1-3H3,(H2,23,24,27)