Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-4-methyl-5-[({2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STK474042
SMILES Cn1c(SCc2csc(n2)c2cccc(c2)C(F)(F)F)nnc1c1ccc2c(c1)OCO2
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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 C21H15F3N4O2S2 MW 476.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F3N4O2S2/c1-28-18(12-5-6-16-17(8-12)30-11-29-16)26-27-20(28)32-10-15-9-31-19(25-15)13-3-2-4-14(7-13)21(22,23)24/h2-9H,10-11H2,1H3InChIKey
UQTWRCWXWLMRQJ-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)4methyl5(((2(3(trifluoromethyl)phenyl)13thiazol4yl)methyl)sulfanyl)4H124triazole
4((5(13benzodioxol5yl)4methyl124triazol3yl)sulfanylmethyl)2(3(trifluoromethyl)phenyl)13thiazole
5(2HBENZO(34D)13DIOXOLEN5YL)4METHYL3((2(3(TRIFLUOROMETHYL)PHENYL)(13THIAZOL4YL))METHYLTHIO)124TRIAZOLE
CN1C(=NN=C1SCC2=CSC(=N2)C3=CC(=CC=C3)C(F)(F)F)C4=CC5=C(C=C4)OCO5
InChI=1SC21H15F3N4O2S2c12818(12561617(812)30112916)262720(28)32101593119(2515)1332414(713)21(2223)24h29H1011H21H3
MFCD07612681
ZINC000020427886
ZINC20427886
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