methyl 4-methylidene-6-(4-methylsulfanylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 4-methylidene-6-(4-methylsulfanylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 4-methylene-6-(4-methylsulfanylphenyl)-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-6-[4-(methylthio)phenyl]-2-sulfanylidene-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 4-methylidene-6-(4-methylsulfanylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: 4-methylene-6-[4-(methylthio)phenyl]-2-thioxo-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(NC(=S)NC1=C)C2=CC=C(C=C2)SC

Isomeric SMILES

COC(=O)C1C(NC(=S)NC1=C)C2=CC=C(C=C2)SC

InChI

InChI=1S/C14H16N2O2S2/c1-8-11(13(17)18-2)12(16-14(19)15-8)9-4-6-10(20-3)7-5-9/h4-7,11-12H,1H2,2-3H3,(H2,15,16,19)