Vitas-M small molecule compound

3-[(1,3-benzodioxol-5-yloxy)methyl]-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK645931
SMILES c1ccc(cc1)c1nn2c(s1)nnc2COc1ccc2c(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 C17H12N4O3S MW 352.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O3S/c1-2-4-11(5-3-1)16-20-21-15(18-19-17(21)25-16)9-22-12-6-7-13-14(8-12)24-10-23-13/h1-8H,9-10H2
InChIKey
OUOSCNHTFSSBJM-UHFFFAOYSA-N
Synonyms
1081145-02-9
1081145029
3((13benzodioxol5yloxy)methyl)6phenyl(124)triazolo(34b)(134)thiadiazole
3((benzo(d)(13)dioxol5yloxy)methyl)6phenyl(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yloxymethyl)6phenyl(124)triazolo(34b)(134)thiadiazole
C1OC2=C(O1)C=C(C=C2)OCC3=NN=C4N3N=C(S4)C5=CC=CC=C5
InChI=1SC17H12N4O3Sc12411(531)16202115(181917(21)2516)92212671314(812)24102313h18H910H2
MFCD12205390
ZINC000020715509
ZINC20715509

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Available files

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