methyl 4-[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-[2-(4-acetamidophenyl)-2-oxo-ethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate CAS Name: 4-[[2-(4-acetamidophenyl)-2-oxoethyl]thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-(4-acetamidophenyl)-2-oxoethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 4-[[2-(4-acetamidophenyl)-2-keto-ethyl]thio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)C2=CC=C(C=C2)NC(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)C2=CC=C(C=C2)NC(=O)C)C(=O)OC

InChI

InChI=1S/C17H17N3O5S/c1-9-14(16(23)25-3)15(20-17(24)18-9)26-8-13(22)11-4-6-12(7-5-11)19-10(2)21/h4-7H,8H2,1-3H3,(H,19,21)(H,18,20,24)