Vitas-M small molecule compound
6-[(2-ethoxyphenoxy)methyl]-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL221368
SMILES CCOc1ccccc1OCc1nn2c(s1)nnc2C12CC3CC(C2)CC(C1)C3
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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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-2-27-17-5-3-4-6-18(17)28-13-19-25-26-20(23-24-21(26)29-19)22-10-14-7-15(11-22)9-16(8-14)12-22/h3-6,14-16H,2,7-13H2,1H3InChIKey
CDPSDHBXHFWMJU-UHFFFAOYSA-NSynonyms
3(1adamantyl)6((2ethoxyphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
6((2ethoxyphenoxy)methyl)3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
CCOC1=CC=CC=C1OCC2=NN3C(=NN=C3S2)C45CC6CC(C4)CC(C6)C5
InChI=1SC22H26N4O2Sc122717534618(17)281319252620(232421(26)2919)221014715(1122)916(814)1222h361416H2713H21H3
ZINC000080346199
ZINC80346199
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