methyl 5-(phenylmethylsulfanyl)-2-sulfanylidene-1,3-dithiole-4-carboxylate

Systemtic Name: methyl 5-(phenylmethylsulfanyl)-2-sulfanylidene-1,3-dithiole-4-carboxylate Openeye Name: methyl 5-benzylsulfanyl-2-thioxo-1,3-dithiole-4-carboxylate CAS Name: 5-(phenylmethylthio)-2-sulfanylidene-1,3-dithiole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-benzylsulfanyl-2-sulfanylidene-1,3-dithiole-4-carboxylate Traditional Name: 5-(benzylthio)-2-thioxo-1,3-dithiole-4-carboxylic acid methyl ester Formula: C12H10O2S4 MolecularWeight: 314.4666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=S)S1)SCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(SC(=S)S1)SCC2=CC=CC=C2

InChI

InChI=1S/C12H10O2S4/c1-14-10(13)9-11(18-12(15)17-9)16-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3