Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-5-(3-phenyl-1H-pyrazol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK594988
SMILES S=c1[nH]nc(n1c1ccc2c(c1)OCO2)c1[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 C18H13N5O2S MW 363.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O2S/c26-18-22-21-17(14-9-13(19-20-14)11-4-2-1-3-5-11)23(18)12-6-7-15-16(8-12)25-10-24-15/h1-9H,10H2,(H,19,20)(H,22,26)InChIKey
BJPZOHSGTDIFAA-UHFFFAOYSA-NSynonyms
879445-88-24(13benzodioxol5yl)5(3phenyl1Hpyrazol5yl)24dihydro3H124triazole3thione
879445882
MFCD07200258
S=c1(nH)nc(n1c1ccc2c(c1)OCO2)c1(nH)nc(c1)c1ccccc1
ZINC000005905799
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