ethyl 4-(4-acetyloxyphenyl)-3-ethanoyl-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-acetyloxyphenyl)-3-ethanoyl-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-acetoxyphenyl)-3-acetyl-6-methyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-acetyl-4-(4-acetyloxyphenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyl-4-(4-acetyloxyphenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(4-acetoxyphenyl)-3-acetyl-6-methyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)N(C1C2=CC=C(C=C2)OC(=O)C)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)N(C1C2=CC=C(C=C2)OC(=O)C)C(=O)C)C

InChI

InChI=1S/C18H20N2O5S/c1-5-24-17(23)15-10(2)19-18(26)20(11(3)21)16(15)13-6-8-14(9-7-13)25-12(4)22/h6-9,16H,5H2,1-4H3,(H,19,26)