Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-6-[5-(2-methylpropyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK788008
SMILES COc1ccc(cc1OC)c1nnc2n1nc(s2)c1n[nH]c(c1)CC(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/c1-10(2)7-12-9-13(20-19-12)17-23-24-16(21-22-18(24)27-17)11-5-6-14(25-3)15(8-11)26-4/h5-6,8-10H,7H2,1-4H3,(H,19,20)InChIKey
VYNZVNGPPYQOOW-UHFFFAOYSA-NSynonyms
1045818-06-11045818061
3(34dimethoxyphenyl)6(3isobutyl1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
3(34dimethoxyphenyl)6(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN3C(=NN=C3S2)C4=CC(=C(C=C4)OC)OC
COc1ccc(cc1OC)c1nnc2n1nc(s2)c1(nH)nc(c1)CC(C)C
COc1ccc(cc1OC)c1nnc2n1nc(s2)c1n(nH)c(c1)CC(C)C
InChI=1SC18H20N6O2Sc110(2)712913(201912)17232416(212218(24)2717)115614(253)15(811)264h56810H7H214H3(H1920)
MFCD09796671
ZINC000009421110
ZINC09421110
ZINC9421110
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