Vitas-M small molecule compound

3-[(4-fluorophenoxy)methyl]-6-(4-methoxybenzyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK238832
SMILES COc1ccc(cc1)Cc1nn2c(s1)nnc2COc1ccc(cc1)F

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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 C18H15FN4O2S MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15FN4O2S/c1-24-14-6-2-12(3-7-14)10-17-22-23-16(20-21-18(23)26-17)11-25-15-8-4-13(19)5-9-15/h2-9H,10-11H2,1H3
InChIKey
TVKAHDWQCGRBAI-UHFFFAOYSA-N
Synonyms

3((4fluorophenoxy)methyl)6((4methoxyphenyl)methyl)(124)triazolo(34b)(134)thiadiazole
3((4fluorophenoxy)methyl)6(4methoxybenzyl)(124)triazolo(34b)(134)thiadiazole
COC1=CC=C(C=C1)CC2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)F
InChI=1SC18H15FN4O2Sc124146212(3714)1017222316(202118(23)2617)1125158413(19)5915h29H1011H21H3
MFCD08684111
ZINC000008393380
ZINC08393380
ZINC8393380

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Available files

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