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

Systemtic Name: bis(2-ethylhexyl) 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]butanedioate Openeye Name: bis(2-ethylhexyl) 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)sulfanyl]butanedioate CAS Name: 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]butanedioic acid bis(2-ethylhexyl) ester IUPAC Name: bis(2-ethylhexyl) 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanyl]butanedioate Traditional Name: 2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)thio]succinic acid bis(2-ethylhexyl) ester Formula: C22H38N2O4S3 MolecularWeight: 490.74312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38N2O4S3/c1-5-9-11-16(7-3)14-27-19(25)13-18(30-22-24-23-21(29)31-22)20(26)28-15-17(8-4)12-10-6-2/h16-18H,5-15H2,1-4H3,(H,23,29)