Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-6-[(2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK644034
SMILES CC1(C)CCc2c(O1)ccc(c2)Cc1nn2c(s1)nnc2c1ccc2c(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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-22(2)8-7-14-9-13(3-5-16(14)29-22)10-19-25-26-20(23-24-21(26)30-19)15-4-6-17-18(11-15)28-12-27-17/h3-6,9,11H,7-8,10,12H2,1-2H3InChIKey
RMBJTVLGKJKTBZ-UHFFFAOYSA-NSynonyms
1040697-05-91040697059
3(13benzodioxol5yl)6((22dimethyl34dihydro2Hchromen6yl)methyl)(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yl)6((22dimethyl34dihydrochromen6yl)methyl)(124)triazolo(34b)(134)thiadiazole
3(benzo(d)(13)dioxol5yl)6((22dimethylchroman6yl)methyl)(124)triazolo(34b)(134)thiadiazole
CC1(CCC2=C(O1)C=CC(=C2)CC3=NN4C(=NN=C4S3)C5=CC6=C(C=C5)OCO6)C
InChI=1SC22H20N4O3Sc122(2)8714913(3516(14)2922)1019252620(232421(26)3019)15461718(1115)28122717h36911H781012H212H3
MFCD12209535
ZINC000020739664
ZINC20739664
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