Vitas-M small molecule compound
5-(3-tert-butyl-1H-pyrazol-5-yl)-4-(pyridin-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK629975
SMILES S=c1[nH]nc(n1c1cccnc1)c1[nH]nc(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 C14H16N6S MW 300.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N6S/c1-14(2,3)11-7-10(16-17-11)12-18-19-13(21)20(12)9-5-4-6-15-8-9/h4-8H,1-3H3,(H,16,17)(H,19,21)InChIKey
VXOIVHMXMVSVOA-UHFFFAOYSA-NSynonyms
1025722-60-41025722604
3(5tertbutyl1Hpyrazol3yl)4pyridin3yl1H124triazole5thione
5(3tertbutyl1Hpyrazol5yl)4(pyridin3yl)24dihydro3H124triazole3thione
CC(C)(C)C1=CC(=NN1)C2=NNC(=S)N2C3=CN=CC=C3
InChI=1SC14H16N6Sc114(23)11710(161711)12181913(21)20(12)95461589h48H13H3(H1617)(H1921)
MFCD09796972
S=c1(nH)nc(n1c1cccnc1)c1(nH)nc(c1)C(C)(C)C
ZINC000009421217
ZINC9421217
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