Vitas-M small molecule compound

4-ethyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK197864
SMILES CCn1c(COc2ccccc2C)nnc1S

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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 C12H15N3OS MW 249.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3OS/c1-3-15-11(13-14-12(15)17)8-16-10-7-5-4-6-9(10)2/h4-7H,3,8H2,1-2H3,(H,14,17)
InChIKey
SKWYYPGBQTZOQF-UHFFFAOYSA-N
Synonyms
403990-81-8
403990818
4ETHYL3((2METHYLPHENOXY)METHYL)1H124TRIAZOLE5THIONE
4ETHYL5((2METHYLPHENOXY)METHYL)
4ETHYL5((2METHYLPHENOXY)METHYL)124TRIAZOLE3THIOL
4ETHYL5((2METHYLPHENOXY)METHYL)4H124TRIAZOLE3THIOL
4ETHYL5((OTOLYLOXY)METHYL)4H124TRIAZOLE3THIOL
4ETHYL5(2METHYLPHENOXYMETHYL)124TRIAZOLE3THIOL
CCN1C(=NNC1=S)COC2=CC=CC=C2C
InChI=1SC12H15N3OSc131511(131412(15)17)8161075469(10)2h47H38H212H3(H1417)
MFCD03943522
ZINC000002522229
ZINC2522229

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Available files

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