Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-6-benzyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL234439
SMILES c1ccc(cc1)Cc1nn2c(s1)nnc2c1ccc2c(c1)OCO2
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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 C17H12N4O2S MW 336.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O2S/c1-2-4-11(5-3-1)8-15-20-21-16(18-19-17(21)24-15)12-6-7-13-14(9-12)23-10-22-13/h1-7,9H,8,10H2InChIKey
QQFPCHUUAHDFEO-UHFFFAOYSA-NSynonyms
122222-13-3122222133
3(13benzodioxol5yl)6benzyl(124)triazolo(34b)(134)thiadiazole
3(benzo(d)(13)dioxol5yl)6benzyl(124)triazolo(34b)(134)thiadiazole
C1OC2=C(O1)C=C(C=C2)C3=NN=C4N3N=C(S4)CC5=CC=CC=C5
InChI=1SC17H12N4O2Sc12411(531)815202116(181917(21)2415)12671314(912)23102213h179H810H2
MFCD09849543
ZINC000013682222
ZINC13682222
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