Vitas-M small molecule compound
5-(3-chloro-1-benzothiophen-2-yl)-4-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STL415726
SMILES CCn1c(S)nnc1c1sc2c(c1Cl)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H10ClN3S2 MW 295.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClN3S2/c1-2-16-11(14-15-12(16)17)10-9(13)7-5-3-4-6-8(7)18-10/h3-6H,2H2,1H3,(H,15,17)InChIKey
WSHCSYRQVYGMDS-UHFFFAOYSA-NSynonyms
3(3chloro1benzothiophen2yl)4ethyl1H124triazole5thione
5(3chloro1benzothiophen2yl)4ethyl4H124triazole3thiol
CCN1C(=NNC1=S)C2=C(C3=CC=CC=C3S2)Cl
InChI=1SC12H10ClN3S2c121611(141512(16)17)109(13)753468(7)1810h36H2H21H3(H1517)
MFCD09218858
ZINC000009189674
ZINC09189674
ZINC9189674
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