Vitas-M small molecule compound

3-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-[(3-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK228970
SMILES Cc1cccc(c1)OCc1sc2n(n1)c(nn2)C1COc2c(O1)cccc2

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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 C19H16N4O3S MW 380.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O3S/c1-12-5-4-6-13(9-12)24-11-17-22-23-18(20-21-19(23)27-17)16-10-25-14-7-2-3-8-15(14)26-16/h2-9,16H,10-11H2,1H3
InChIKey
DFKMACFTTSDVHP-UHFFFAOYSA-N
Synonyms

(3(23DIHYDRO14BENZODIOXIN2YL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)METHYL3METHYLPHENYLETHER
3(23DIHYDRO14BENZODIOXIN2YL)6((3METHYLPHENOXY)METHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(23DIHYDRO14BENZODIOXIN3YL)6((3METHYLPHENOXY)METHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
CC1=CC(=CC=C1)OCC2=NN3C(=NN=C3S2)C4COC5=CC=CC=C5O4
InChI=1SC19H16N4O3Sc11254613(912)241117222318(202119(23)2717)16102514723815(14)2616h2916H1011H21H3
MFCD06590402
ZINC000004384010
ZINC000004384011

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Available files

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