Vitas-M small molecule compound
3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-[(4-methoxyphenoxy)methyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK465194
SMILES COc1ccc(cc1)OCc1nnc(n1C)SCc1csc(n1)c1ccc2c(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 C22H20N4O4S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S2/c1-26-20(10-28-17-6-4-16(27-2)5-7-17)24-25-22(26)32-12-15-11-31-21(23-15)14-3-8-18-19(9-14)30-13-29-18/h3-9,11H,10,12-13H2,1-2H3InChIKey
XUXNBIUFNPGTCS-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)4((5((4methoxyphenoxy)methyl)4methyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(13benzodioxol5yl)13thiazol4yl)methyl)sulfanyl)5((4methoxyphenoxy)methyl)4methyl4H124triazole
CN1C(=NN=C1SCC2=CSC(=N2)C3=CC4=C(C=C3)OCO4)COC5=CC=C(C=C5)OC
InChI=1SC22H20N4O4S2c12620(1028176416(272)5717)242522(26)321215113121(2315)14381819(914)30132918h3911H101213H212H3
MFCD06756103
ZINC000020427860
ZINC20427860
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