Vitas-M small molecule compound
2-(pyridin-2-yl)-1-{[6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Catalog ID
STL300363
SMILES c1ccc(nc1)c1nc2c(n1Cc1nnc3n1nc(s3)C13CC4CC(C3)CC(C1)C4)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 C26H25N7S MW 467.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N7S/c1-2-7-21-19(5-1)28-23(20-6-3-4-8-27-20)32(21)15-22-29-30-25-33(22)31-24(34-25)26-12-16-9-17(13-26)11-18(10-16)14-26/h1-8,16-18H,9-15H2InChIKey
GDBNNLJZEFKOHM-UHFFFAOYSA-NSynonyms
2(pyridin2yl)1((6(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazol3yl)methyl)1Hbenzimidazole
6(1adamantyl)3((2pyridin2ylbenzimidazol1yl)methyl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN5C(=NN=C5S4)CN6C7=CC=CC=C7N=C6C8=CC=CC=N8
InChI=1SC26H25N7Sc1272119(51)2823(2063482720)32(21)152229302533(22)3124(3425)261216917(1326)1118(1016)1426h181618H915H2
ZINC000095471836
ZINC95471836
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