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

Systemtic Name: ethyl 4-[2-chloranyl-4-(2-ethoxy-2-oxidanylidene-ethoxy)-5-methoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-chloro-4-(2-ethoxy-2-oxo-ethoxy)-5-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[2-chloro-4-(2-ethoxy-2-oxoethoxy)-5-methoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-chloro-4-(2-ethoxy-2-oxoethoxy)-5-methoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[2-chloro-4-(2-ethoxy-2-keto-ethoxy)-5-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23ClN2O6S MolecularWeight: 442.91372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C(=C1)Cl)C2C(=C(NC(=S)N2)C)C(=O)OCC)OC

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C(=C1)Cl)C2C(=C(NC(=S)N2)C)C(=O)OCC)OC

InChI

InChI=1S/C19H23ClN2O6S/c1-5-26-15(23)9-28-14-8-12(20)11(7-13(14)25-4)17-16(18(24)27-6-2)10(3)21-19(29)22-17/h7-8,17H,5-6,9H2,1-4H3,(H2,21,22,29)