Vitas-M small molecule compound
5-bromo-3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-3-hydroxy-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK213036
SMILES C#CCN1c2ccc(cc2C(C1=O)(O)CC(=O)c1ccc2c(c1)OCCO2)Br
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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 C21H16BrNO5 MW 442.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrNO5/c1-2-7-23-16-5-4-14(22)11-15(16)21(26,20(23)25)12-17(24)13-3-6-18-19(10-13)28-9-8-27-18/h1,3-6,10-11,26H,7-9,12H2InChIKey
GYIWEIGQMMHOFK-UHFFFAOYSA-NSynonyms
(3S)5BROMO3(2(23DIHYDRO14BENZODIOXIN6YL)2OXOETHYL)3HYDROXY1(PROP2YN1YL)13DIHYDRO2HINDOL2ONE
5BROMO3(2(23DIHYDRO14BENZODIOXIN6YL)2OXOETHYL)3HYDROXY1(2PROPYNYL)13DIHYDRO2HINDOL2ONE
5bromo3(2(23dihydro14benzodioxin6yl)2oxoethyl)3hydroxy1(prop2yn1yl)13dihydro2Hindol2one
5BROMO3(2(23DIHYDRO14BENZODIOXIN6YL)2OXOETHYL)3HYDROXY1PROP2YNYLINDOL2ONE
C#CCN1C2=C(C=C(C=C2)Br)C(C1=O)(CC(=O)C3=CC4=C(C=C3)OCCO4)O
InChI=1SC21H16BrNO5c12723165414(22)1115(16)21(2620(23)25)1217(24)13361819(1013)28982718h136101126H7912H2
MFCD06007082
ZINC000001065065
ZINC000010058888
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