Vitas-M small molecule compound
6-(3,4-dimethoxyphenyl)-3-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL048449
SMILES COc1cc(ccc1OC)c1nn2c(s1)nnc2c1[nH]nc2c1CCC2
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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 C17H16N6O2S MW 368.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N6O2S/c1-24-12-7-6-9(8-13(12)25-2)16-22-23-15(20-21-17(23)26-16)14-10-4-3-5-11(10)18-19-14/h6-8H,3-5H2,1-2H3,(H,18,19)InChIKey
NJFJMFNCHDNYDN-UHFFFAOYSA-NSynonyms
12DIMETHOXY4(3(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))BENZENE
3(1H4H5H6HCYCLOPENTA(C)PYRAZOL3YL)6(34DIMETHOXYPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
6(34dimethoxyphenyl)3(1456tetrahydrocyclopenta(c)pyrazol3yl)(124)triazolo(34b)(134)thiadiazole
6(34dimethoxyphenyl)3(2456tetrahydrocyclopenta(c)pyrazol3yl)(124)triazolo(34b)(134)thiadiazole
877785052
COC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)C4=NNC5=C4CCC5)OC
COc1cc(ccc1OC)c1nn2c(s1)nnc2c1(nH)nc2c1CCC2
COc1cc(ccc1OC)c1nn2c(s1)nnc2c1n(nH)c2c1CCC2
InChI=1SC17H16N6O2Sc12412769(813(12)252)16222315(202117(23)2616)141043511(10)181914h68H35H212H3(H1819)
MFCD05726500
ZINC000005460109
ZINC05460109
ZINC5460109
Check stock
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Check stock on Vitas-MAvailable files
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