methyl 3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate

Systemtic Name: methyl 3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate Openeye Name: methyl 3-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate CAS Name: 3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate Traditional Name: 3-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)thio]propionic acid methyl ester Formula: C6H8N2O2S3 MolecularWeight: 236.33492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NNC(=S)S1

Isomeric SMILES

COC(=O)CCSC1=NNC(=S)S1

InChI

InChI=1S/C6H8N2O2S3/c1-10-4(9)2-3-12-6-8-7-5(11)13-6/h2-3H2,1H3,(H,7,11)