Vitas-M small molecule compound

5-ethyl-4-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK444741
SMILES COc1cccc(c1)n1c(S)nnc1CC

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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 C11H13N3OS MW 235.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3OS/c1-3-10-12-13-11(16)14(10)8-5-4-6-9(7-8)15-2/h4-7H,3H2,1-2H3,(H,13,16)
InChIKey
DNBIKWNMGCMLAM-UHFFFAOYSA-N
Synonyms

3ethyl4(3methoxyphenyl)1H124triazole5thione
5ETHYL4(3METHOXYPHENYL)124TRIAZOLE3THIOL
5ethyl4(3methoxyphenyl)4H124triazole3thiol
CCC1=NNC(=S)N1C2=CC(=CC=C2)OC
InChI=1SC11H13N3OSc1310121311(16)14(10)85469(78)152h47H3H212H3(H1316)
MFCD04057520
ZINC000006395611
ZINC06395611
ZINC6395611

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Available files

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