5-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]pentanoate

Systemtic Name: 5-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]pentanoate Openeye Name: 5-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]pentanoate CAS Name: 5-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]pentanoate IUPAC Name: 5-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]pentanoate Traditional Name: 5-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]valerate Formula: C8H11N2O2S3- MolecularWeight: 263.38014

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=N1)SCCCCC(=O)[O-]

Isomeric SMILES

CSC1=NSC(=N1)SCCCCC(=O)[O-]

InChI

InChI=1S/C8H12N2O2S3/c1-13-7-9-8(15-10-7)14-5-3-2-4-6(11)12/h2-5H2,1H3,(H,11,12)/p-1