3-[[5-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate

Systemtic Name: 3-[[5-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Openeye Name: 3-[[5-[2-(methylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate CAS Name: 3-[[5-[[2-(methylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]thio]propanoate IUPAC Name: 3-[[5-[2-(methylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Traditional Name: 3-[[5-[[2-keto-2-(methylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]thio]propionate Formula: C8H10N3O3S3- MolecularWeight: 292.3783

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NN=C(S1)SCCC(=O)[O-]

Isomeric SMILES

CNC(=O)CSC1=NN=C(S1)SCCC(=O)[O-]

InChI

InChI=1S/C8H11N3O3S3/c1-9-5(12)4-16-8-11-10-7(17-8)15-3-2-6(13)14/h2-4H2,1H3,(H,9,12)(H,13,14)/p-1