Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STK279345
SMILES CCn1c(SCCOc2ccccc2)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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-2-23-19(15-8-9-17-18(14-15)26-11-10-25-17)21-22-20(23)27-13-12-24-16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3InChIKey
WYJCAOZPHAATOK-UHFFFAOYSA-NSynonyms
3(23DIHYDRO14BENZODIOXIN6YL)4ETHYL5((2PHENOXYETHYL)SULFANYL)4H124TRIAZOLE
3(23dihydro14benzodioxin6yl)4ethyl5(2phenoxyethylsulfanyl)124triazole
CCN1C(=NN=C1SCCOC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4
InChI=1SC20H21N3O3Sc122319(15891718(1415)2611102517)212220(23)27131224166435716h3914H21013H21H3
MFCD09269783
ZINC000009096211
ZINC09096211
ZINC9096211
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