Vitas-M small molecule compound
methyl 9-methyl-2-{[3-(2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]methyl}thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL177045
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)CC12CC3CC(C1)CC(C2)(C3)n1nncn1
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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 C22H24N8O2S MW 464.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N8O2S/c1-12-16-18-26-15(27-29(18)11-23-19(16)33-17(12)20(31)32-2)8-21-4-13-3-14(5-21)7-22(6-13,9-21)30-25-10-24-28-30/h10-11,13-14H,3-9H2,1-2H3InChIKey
OJQGUBBRUXNNAA-UHFFFAOYSA-NSynonyms
832135-20-3832135203
CC1=C(SC2=C1C3=NC(=NN3C=N2)CC45CC6CC(C4)CC(C6)(C5)N7N=CN=N7)C(=O)OC
InChI=1SC22H24N8O2Sc11216182615(2729(18)112319(16)3317(12)20(31)322)821413314(521)722(613921)302510242830h10111314H39H212H3
methyl9methyl2((3(2Htetrazol2yl)tricyclo(3311~37~)dec1yl)methyl)thieno(32e)(124)triazolo(15c)pyrimidine8carboxylate
ZINC000013642884
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Check stock on Vitas-MAvailable files
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