Vitas-M small molecule compound
6-[(3-methylphenoxy)methyl]-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL193455
SMILES Cc1cccc(c1)OCc1nn2c(s1)nnc2C12CC3CC(C2)CC(C1)C3
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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 C21H24N4OS MW 380.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4OS/c1-13-3-2-4-17(5-13)26-12-18-24-25-19(22-23-20(25)27-18)21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3InChIKey
CSUKJBOJEQMLFA-UHFFFAOYSA-NSynonyms
3(1adamantyl)6((3methylphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
6((3methylphenoxy)methyl)3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
CC1=CC(=CC=C1)OCC2=NN3C(=NN=C3S2)C45CC6CC(C4)CC(C6)C5
InChI=1SC21H24N4OSc11332417(513)261218242519(222320(25)2718)21914615(1021)816(714)1121h251416H612H21H3
MFCD22391050
ZINC000072333568
ZINC72333568
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