methyl 3-ethanoyl-6-methyl-4-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-ethanoyl-6-methyl-4-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-acetyl-6-methyl-4-phenyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-acetyl-6-methyl-4-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-acetyl-6-methyl-4-phenyl-2-sulfanylidene-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-acetyl-6-methyl-4-phenyl-2-thioxo-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=S)N1)C(=O)C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(N(C(=S)N1)C(=O)C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H16N2O3S/c1-9-12(14(19)20-3)13(11-7-5-4-6-8-11)17(10(2)18)15(21)16-9/h4-8,13H,1-3H3,(H,16,21)