Vitas-M small molecule compound
6-(3,4-dimethoxyphenyl)-3-(3-phenyl-1H-pyrazol-5-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL032003
SMILES COc1cc(ccc1OC)c1nn2c(s1)nnc2c1[nH]nc(c1)c1ccccc1
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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 C20H16N6O2S MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6O2S/c1-27-16-9-8-13(10-17(16)28-2)19-25-26-18(23-24-20(26)29-19)15-11-14(21-22-15)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,21,22)InChIKey
JIMOCTBCBAXWCH-UHFFFAOYSA-NSynonyms
850750-26-412DIMETHOXY4(3(3PHENYLPYRAZOL5YL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))BENZENE
5(6(34DIMETHOXYPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOL3YL)3PHENYL1HPYRAZOLE
6(34dimethoxyphenyl)3(3phenyl1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
850750264
COC1=C(C=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC(=NN4)C5=CC=CC=C5)OC
COc1cc(ccc1OC)c1nn2c(s1)nnc2c1(nH)nc(c1)c1ccccc1
InChI=1SC20H16N6O2Sc127169813(1017(16)282)19252618(232420(26)2919)151114(212215)126435712h311H12H3(H2122)
MFCD05694644
ZINC000005457439
ZINC05457439
ZINC5457439
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