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Basic information
- CAS
696623-57-1- Standard SMILES
O=C(CSc1n[nH]c(-c2ccccc2Cl)n1)c1ccc(O)c(O)c1- InChIKey
WJSDXVCIEJFLPM-UHFFFAOYSA-N- Molecular formula
- C16H12ClN3O3S
- Average molar mass
- 361.81 g/mol
- Monoisotopic mass
- 361.02878992
Names & identifiers
- Preferred name
- 2-[[3-(2-Chlorophenyl)-1H-1,2,4-triazol-5-yl]thio]-1-(3,4-dihydroxyphenyl)ethanone
- IUPAC
- 2-{[5-(2-Chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethan-1-one
Database identifiers
- CAS
696623-57-1- PubChem CID
- 1251069
- DTXSID
DTXSID201131965- ChEMBL
CHEMBL1330574
Related reactions
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Compound notes
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