Vitas-M small molecule compound

3-(methoxymethyl)-6-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK318473
SMILES COCc1nnc2n1nc(s2)Cc1ccc2c(c1)CCCC2

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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 C16H18N4OS MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4OS/c1-21-10-14-17-18-16-20(14)19-15(22-16)9-11-6-7-12-4-2-3-5-13(12)8-11/h6-8H,2-5,9-10H2,1H3
InChIKey
MDKWKBSKHSCIFL-UHFFFAOYSA-N
Synonyms
903184-20-3
3(methoxymethyl)6((5678tetrahydronaphthalen2yl)methyl)(124)triazolo(34b)(134)thiadiazole
3(methoxymethyl)6(5678tetrahydronaphthalen2ylmethyl)(124)triazolo(34b)(134)thiadiazole
903184203
COCC1=NN=C2N1N=C(S2)CC3=CC4=C(CCCC4)C=C3
InChI=1SC16H18N4OSc121101417181620(14)1915(2216)9116712423513(12)811h68H25910H21H3
MFCD08072771
ZINC000006669832
ZINC06669832
ZINC6669832

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Available files

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