ethyl 6-methyl-2-oxidanylidene-4-(phenylmethylsulfanyl)-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-2-oxidanylidene-4-(phenylmethylsulfanyl)-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-benzylsulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-oxo-4-(phenylmethylthio)-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-benzylsulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 4-(benzylthio)-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N=C1SCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N=C1SCC2=CC=CC=C2)C

InChI

InChI=1S/C15H16N2O3S/c1-3-20-14(18)12-10(2)16-15(19)17-13(12)21-9-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,16,17,19)