Vitas-M small molecule compound

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

Catalog ID
STK640772
SMILES Clc1ccc(cc1)Cc1sc2n(n1)c(nn2)COc1ccc2c(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 C18H13ClN4O3S MW 400.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN4O3S/c19-12-3-1-11(2-4-12)7-17-22-23-16(20-21-18(23)27-17)9-24-13-5-6-14-15(8-13)26-10-25-14/h1-6,8H,7,9-10H2
InChIKey
RZOXSKOSNDWTAG-UHFFFAOYSA-N
Synonyms
1081141-25-4
1081141254
3((13benzodioxol5yloxy)methyl)6(4chlorobenzyl)(124)triazolo(34b)(134)thiadiazole
3((benzo(d)(13)dioxol5yloxy)methyl)6(4chlorobenzyl)(124)triazolo(34b)(134)thiadiazole
3(13benzodioxol5yloxymethyl)6((4chlorophenyl)methyl)(124)triazolo(34b)(134)thiadiazole
C1OC2=C(O1)C=C(C=C2)OCC3=NN=C4N3N=C(S4)CC5=CC=C(C=C5)Cl
InChI=1SC18H13ClN4O3Sc19123111(2412)717222316(202118(23)2717)92413561415(813)26102514h168H7910H2
MFCD12207626
ZINC000020728791
ZINC20728791

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Available files

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