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

Systemtic Name: 2-ethylhexyl 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate Openeye Name: 2-ethylhexyl 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate CAS Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]propanoate Traditional Name: 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)thio]propionic acid 2-ethylhexyl ester Formula: C13H22N2O2S3 MolecularWeight: 334.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(C)SC1=NNC(=S)S1

Isomeric SMILES

CCCCC(CC)COC(=O)C(C)SC1=NNC(=S)S1

InChI

InChI=1S/C13H22N2O2S3/c1-4-6-7-10(5-2)8-17-11(16)9(3)19-13-15-14-12(18)20-13/h9-10H,4-8H2,1-3H3,(H,14,18)