methyl 3-(1H-1,2,4-triazol-5-ylsulfanyl)propanoate

Systemtic Name: methyl 3-(1H-1,2,4-triazol-5-ylsulfanyl)propanoate Openeye Name: methyl 3-(1H-1,2,4-triazol-5-ylsulfanyl)propanoate CAS Name: 3-(1H-1,2,4-triazol-5-ylthio)propanoic acid methyl ester IUPAC Name: methyl 3-(1H-1,2,4-triazol-5-ylsulfanyl)propanoate Traditional Name: 3-(1H-1,2,4-triazol-5-ylthio)propionic acid methyl ester Formula: C6H9N3O2S MolecularWeight: 187.21956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC=NN1

Isomeric SMILES

COC(=O)CCSC1=NC=NN1

InChI

InChI=1S/C6H9N3O2S/c1-11-5(10)2-3-12-6-7-4-8-9-6/h4H,2-3H2,1H3,(H,7,8,9)