Vitas-M small molecule compound
6-(5-tert-butyl-1H-pyrazol-3-yl)-3-(3,5-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK930966
SMILES COc1cc(OC)cc(c1)c1nnc2n1nc(s2)c1n[nH]c(c1)C(C)(C)C
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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 C18H20N6O2S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O2S/c1-18(2,3)14-9-13(19-20-14)16-23-24-15(21-22-17(24)27-16)10-6-11(25-4)8-12(7-10)26-5/h6-9H,1-5H3,(H,19,20)InChIKey
LCKVPXPQLGVFHA-UHFFFAOYSA-NSynonyms
1269833-46-61269833466
6(3(tertbutyl)1Hpyrazol5yl)3(35dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
6(5tertbutyl1Hpyrazol3yl)3(35dimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=CC(=NN1)C2=NN3C(=NN=C3S2)C4=CC(=CC(=C4)OC)OC
COc1cc(OC)cc(c1)c1nnc2n1nc(s2)c1(nH)nc(c1)C(C)(C)C
COc1cc(OC)cc(c1)c1nnc2n1nc(s2)c1n(nH)c(c1)C(C)(C)C
InChI=1SC18H20N6O2Sc118(23)14913(192014)16232415(212217(24)2716)10611(254)812(710)265h69H15H3(H1920)
MFCD18176801
ZINC000040287287
ZINC40287287
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