Vitas-M small molecule compound
5-[3-(3-chloro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]-4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK309789
SMILES CCn1ncc(c1C)n1c(S)nnc1C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)Cl
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C20H25ClN8S MW 444.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN8S/c1-3-27-12(2)15(9-23-27)29-16(24-25-18(29)30)19-5-13-4-14(6-19)8-20(7-13,10-19)28-11-22-17(21)26-28/h9,11,13-14H,3-8,10H2,1-2H3,(H,25,30)InChIKey
PDMLGMDWTBRCIW-UHFFFAOYSA-NSynonyms
1005697-76-61005697766
3(3(3CHLORO124TRIAZOL1YL)1ADAMANTYL)4(1ETHYL5METHYLPYRAZOL4YL)1H124TRIAZOLE5THIONE
5(3(3chloro1H124triazol1yl)tricyclo(3311~37~)dec1yl)4(1ethyl5methyl1Hpyrazol4yl)4H124triazole3thiol
CCN1C(=C(C=N1)N2C(=NNC2=S)C34CC5CC(C3)CC(C5)(C4)N6C=NC(=N6)Cl)C
InChI=1SC20H25ClN8Sc132712(2)15(92327)2916(242518(29)30)19513414(619)820(7131019)28112217(21)2628h9111314H3810H212H3(H2530)
MFCD04133922
ZINC000013960039
Check stock
See real-time availability and sample size for STK309789 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.