Vitas-M small molecule compound
2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,3-dihydro-1H-indol-1-yl)ethanone
Catalog ID
STK279319
SMILES O=C(N1CCc2c1cccc2)CSc1nnc(n1C)c1ccc2c(c1)OCCO2
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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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-24-20(15-6-7-17-18(12-15)28-11-10-27-17)22-23-21(24)29-13-19(26)25-9-8-14-4-2-3-5-16(14)25/h2-7,12H,8-11,13H2,1H3InChIKey
GQIVKCISWUZUSD-UHFFFAOYSA-NSynonyms
2((5(23dihydro14benzodioxin6yl)4methyl124triazol3yl)sulfanyl)1(23dihydroindol1yl)ethanone
2((5(23DIHYDRO14BENZODIOXIN6YL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(23DIHYDRO1HINDOL1YL)ETHANONE
CN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5
InChI=1SC21H20N4O3Sc12420(15671718(1215)2811102717)222321(24)291319(26)259814423516(14)25h2712H81113H21H3
MFCD09269757
ZINC000009096185
ZINC09096185
ZINC9096185
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