Vitas-M small molecule compound
3-{[2-(2-chlorophenoxy)ethyl]sulfanyl}-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-4H-1,2,4-triazole
Catalog ID
STK279315
SMILES Cn1c(SCCOc2ccccc2Cl)nnc1c1ccc2c(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 C19H18ClN3O3S MW 403.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O3S/c1-23-18(13-6-7-16-17(12-13)25-9-8-24-16)21-22-19(23)27-11-10-26-15-5-3-2-4-14(15)20/h2-7,12H,8-11H2,1H3InChIKey
KSHYDAGJESNTSC-UHFFFAOYSA-NSynonyms
3((2(2CHLOROPHENOXY)ETHYL)SULFANYL)5(23DIHYDRO14BENZODIOXIN6YL)4METHYL4H124TRIAZOLE
3(2(2chlorophenoxy)ethylsulfanyl)5(23dihydro14benzodioxin6yl)4methyl124triazole
CN1C(=NN=C1SCCOC2=CC=CC=C2Cl)C3=CC4=C(C=C3)OCCO4
InChI=1SC19H18ClN3O3Sc12318(13671617(1213)25982416)212219(23)2711102615532414(15)20h2712H811H21H3
MFCD09269753
ZINC000009096181
ZINC09096181
ZINC9096181
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