Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-5-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-methyl-4H-1,2,4-triazole
Catalog ID
STK474049
SMILES Cn1c(SCc2csc(n2)c2ccc3c(c2)OCO3)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 C21H16N4O4S2 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O4S2/c1-25-19(12-2-4-15-17(6-12)28-10-26-15)23-24-21(25)31-9-14-8-30-20(22-14)13-3-5-16-18(7-13)29-11-27-16/h2-8H,9-11H2,1H3InChIKey
YNSRRTVNZREXRE-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)4((5(13benzodioxol5yl)4methyl124triazol3yl)sulfanylmethyl)13thiazole
3(13benzodioxol5yl)5(((2(13benzodioxol5yl)13thiazol4yl)methyl)sulfanyl)4methyl4H124triazole
5(2HBENZO(34D)13DIOXOLEN5YL)3((2(2HBENZO(34D)13DIOXOLEN5YL)(13THIAZOL4YL))METHYLTHIO)4METHYL124TRIAZOLE
CN1C(=NN=C1SCC2=CSC(=N2)C3=CC4=C(C=C3)OCO4)C5=CC6=C(C=C5)OCO6
InChI=1SC21H16N4O4S2c12519(12241517(612)28102615)232421(25)3191483020(2214)13351618(713)29112716h28H911H21H3
MFCD07612688
ZINC000020427876
ZINC20427876
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