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

Systemtic Name: 3-[[5-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Openeye Name: 3-[[5-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate CAS Name: 3-[[5-[[2-(dimethylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]thio]propanoate IUPAC Name: 3-[[5-[2-(dimethylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Traditional Name: 3-[[5-[[2-(dimethylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]thio]propionate Formula: C9H12N3O3S3- MolecularWeight: 306.40488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3O3S3/c1-12(2)6(13)5-17-9-11-10-8(18-9)16-4-3-7(14)15/h3-5H2,1-2H3,(H,14,15)/p-1