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2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate

2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name:2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate
Openeye Name:2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate
CAS Name:2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetate
IUPAC Name:2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetate
Traditional Name:2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetate
Formula: C9H7N4O2S-
MolecularWeight: 235.24248
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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=NC(=NN2)SCC(=O)[O-]


Isomeric SMILES

C1=CN=CC=C1C2=NC(=NN2)SCC(=O)[O-]


InChI

InChI=1S/C9H8N4O2S/c14-7(15)5-16-9-11-8(12-13-9)6-1-3-10-4-2-6/h1-4H,5H2,(H,14,15)(H,11,12,13)/p-1


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