Vitas-M small molecule compound

3-butyl-6-(3,4-dimethoxybenzyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL136001
SMILES CCCCc1nnc2n1nc(s2)Cc1ccc(c(c1)OC)OC

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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 C16H20N4O2S MW 332.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2S/c1-4-5-6-14-17-18-16-20(14)19-15(23-16)10-11-7-8-12(21-2)13(9-11)22-3/h7-9H,4-6,10H2,1-3H3
InChIKey
BXGKUNSTNZOOML-UHFFFAOYSA-N
Synonyms

3butyl6((34dimethoxyphenyl)methyl)(124)triazolo(34b)(134)thiadiazole
3butyl6(34dimethoxybenzyl)(124)triazolo(34b)(134)thiadiazole
CCCCC1=NN=C2N1N=C(S2)CC3=CC(=C(C=C3)OC)OC
InChI=1SC16H20N4O2Sc14561417181620(14)1915(2316)10117812(212)13(911)223h79H4610H213H3
MFCD09183423
ZINC000011278090
ZINC11278090

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Available files

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