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

Systemtic Name: ethyl 4-(2,4-dimethylphenyl)-3-ethanoyl-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-acetyl-4-(2,4-dimethylphenyl)-6-methyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-acetyl-4-(2,4-dimethylphenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyl-4-(2,4-dimethylphenyl)-6-methyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-acetyl-4-(2,4-dimethylphenyl)-6-methyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3S/c1-6-23-17(22)15-12(4)19-18(24)20(13(5)21)16(15)14-8-7-10(2)9-11(14)3/h7-9,16H,6H2,1-5H3,(H,19,24)