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

Systemtic Name: ethyl 4-methylidene-6-(4-methylsulfanylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C15H18N2O2S2 MolecularWeight: 322.44562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O2S2/c1-4-19-14(18)12-9(2)16-15(20)17-13(12)10-5-7-11(21-3)8-6-10/h5-8,12-13H,2,4H2,1,3H3,(H2,16,17,20)