Vitas-M small molecule compound
3-(3-phenyl-1H-pyrazol-5-yl)-6-(3,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL032004
SMILES COc1cc(cc(c1OC)OC)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 C21H18N6O3S MW 434.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N6O3S/c1-28-16-9-13(10-17(29-2)18(16)30-3)20-26-27-19(24-25-21(27)31-20)15-11-14(22-23-15)12-7-5-4-6-8-12/h4-11H,1-3H3,(H,22,23)InChIKey
VVZGLXYUVSDVKP-UHFFFAOYSA-NSynonyms
714946-48-2123TRIMETHOXY5(3(3PHENYLPYRAZOL5YL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))BENZENE
3(3phenyl1Hpyrazol5yl)6(345trimethoxyphenyl)(124)triazolo(34b)(134)thiadiazole
3PHENYL5(6(345TRIMETHOXYPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOL3YL)1HPYRAZOLE
714946482
COC1=CC(=CC(=C1OC)OC)C2=NN3C(=NN=C3S2)C4=CC(=NN4)C5=CC=CC=C5
COc1cc(cc(c1OC)OC)c1nn2c(s1)nnc2c1(nH)nc(c1)c1ccccc1
InChI=1SC21H18N6O3Sc12816913(1017(292)18(16)303)20262719(242521(27)3120)151114(222315)127546812h411H13H3(H2223)
MFCD05697593
ZINC000009292101
ZINC09292101
ZINC9292101
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