Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-6-(1-phenyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK787793
SMILES c1ccc(cc1)n1ncc(c1)c1nn2c(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 C19H12N6O2S MW 388.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N6O2S/c1-2-4-14(5-3-1)24-10-13(9-20-24)18-23-25-17(21-22-19(25)28-18)12-6-7-15-16(8-12)27-11-26-15/h1-10H,11H2InChIKey
JRBWVQCIYMGWCD-UHFFFAOYSA-NSynonyms
1171044-10-21171044102
3(13benzodioxol5yl)6(1phenyl1Hpyrazol4yl)(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yl)6(1phenylpyrazol4yl)(124)triazolo(34b)(134)thiadiazole
3(benzo(d)(13)dioxol5yl)6(1phenyl1Hpyrazol4yl)(124)triazolo(34b)(134)thiadiazole
C1OC2=C(O1)C=C(C=C2)C3=NN=C4N3N=C(S4)C5=CN(N=C5)C6=CC=CC=C6
InChI=1SC19H12N6O2Sc12414(531)241013(92024)18232517(212219(25)2818)12671516(812)27112615h110H11H2
MFCD12034549
ZINC000012391673
ZINC12391673
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