methyl 5-[[4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)phenyl]carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)phenyl]carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-(5-methylsulfanyl-2-thioxo-1,3,4-thiadiazol-3-yl)benzoyl]oxymethyl]furan-2-carboxylate CAS Name: 5-[[[4-[5-(methylthio)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(5-methylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)benzoyl]oxymethyl]furan-2-carboxylate Traditional Name: 5-[[4-[5-(methylthio)-2-thioxo-1,3,4-thiadiazol-3-yl]benzoyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C17H14N2O5S3 MolecularWeight: 422.49846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)C2=CC=C(C=C2)N3C(=S)SC(=N3)SC

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)C2=CC=C(C=C2)N3C(=S)SC(=N3)SC

InChI

InChI=1S/C17H14N2O5S3/c1-22-15(21)13-8-7-12(24-13)9-23-14(20)10-3-5-11(6-4-10)19-17(25)27-16(18-19)26-2/h3-8H,9H2,1-2H3