Vitas-M small molecule compound

4-(2,4-difluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK445176
SMILES COCc1nnc(n1c1ccc(cc1F)F)S

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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 C10H9F2N3OS MW 257.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9F2N3OS/c1-16-5-9-13-14-10(17)15(9)8-3-2-6(11)4-7(8)12/h2-4H,5H2,1H3,(H,14,17)
InChIKey
RQMIOFCBMCCFFP-UHFFFAOYSA-N
Synonyms

4(24difluorophenyl)3(methoxymethyl)1H124triazole5thione
4(24DIFLUOROPHENYL)5(METHOXYMETHYL)124TRIAZOLE3THIOL
4(24difluorophenyl)5(methoxymethyl)4H124triazole3thiol
COCC1=NNC(=S)N1C2=C(C=C(C=C2)F)F
InChI=1SC10H9F2N3OSc11659131410(17)15(9)8326(11)47(8)12h24H5H21H3(H1417)
MFCD04057952
ZINC000006397585
ZINC06397585
ZINC6397585

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.