Vitas-M small molecule compound

5-(phenoxymethyl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK617484
SMILES S=c1[nH]nc(n1c1cccnc1)COc1ccccc1

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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 C14H12N4OS MW 284.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4OS/c20-14-17-16-13(10-19-12-6-2-1-3-7-12)18(14)11-5-4-8-15-9-11/h1-9H,10H2,(H,17,20)
InChIKey
MOTMUEPDUFPZKR-UHFFFAOYSA-N
Synonyms
929818-42-8
3(phenoxymethyl)4pyridin3yl1H124triazole5thione
5(phenoxymethyl)4(pyridin3yl)24dihydro3H124triazole3thione
929818428
C1=CC=C(C=C1)OCC2=NNC(=S)N2C3=CN=CC=C3
InChI=1SC14H12N4OSc2014171613(1019126213712)18(14)1154815911h19H10H2(H1720)
MFCD09792871
S=c1(nH)nc(n1c1cccnc1)COc1ccccc1
ZINC000013570829
ZINC13570829

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Available files

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