Vitas-M small molecule compound
6-[(4-tert-butylphenoxy)methyl]-3-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK824339
SMILES CC(c1ccc(cc1)OCc1nn2c(s1)nnc2C1COc2c(O1)cccc2)(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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-22(2,3)14-8-10-15(11-9-14)27-13-19-25-26-20(23-24-21(26)30-19)18-12-28-16-6-4-5-7-17(16)29-18/h4-11,18H,12-13H2,1-3H3InChIKey
CUUNCPOZXOHVHW-UHFFFAOYSA-NSynonyms
876712-65-16((4(tertbutyl)phenoxy)methyl)3(23dihydrobenzo(b)(14)dioxin2yl)(124)triazolo(34b)(134)thiadiazole
6((4tertbutylphenoxy)methyl)3(23dihydro14benzodioxin2yl)(124)triazolo(34b)(134)thiadiazole
6((4TERTBUTYLPHENOXY)METHYL)3(23DIHYDRO14BENZODIOXIN3YL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
876712651
CC(C)(C)C1=CC=C(C=C1)OCC2=NN3C(=NN=C3S2)C4COC5=CC=CC=C5O4
InChI=1SC22H22N4O3Sc122(23)1481015(11914)271319252620(232421(26)3019)18122816645717(16)2918h41118H1213H213H3
MFCD06782935
ZINC000006075459
ZINC000006075460
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