Vitas-M small molecule compound
5-bromo-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK051847
SMILES C#CCN1c2ccc(cc2C(C1=O)(O)CC(=O)c1ccc(c(c1)OC)OC)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 C21H18BrNO5 MW 444.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO5/c1-4-9-23-16-7-6-14(22)11-15(16)21(26,20(23)25)12-17(24)13-5-8-18(27-2)19(10-13)28-3/h1,5-8,10-11,26H,9,12H2,2-3H3InChIKey
HJGXHTYVRYKSMB-UHFFFAOYSA-NSynonyms
5BROMO3(2(34DIMETHOXYPHENYL)2OXOETHYL)3HYDROXY1(2PROPYNYL)13DIHYDRO2HINDOL2ONE
5BROMO3(2(34DIMETHOXYPHENYL)2OXOETHYL)3HYDROXY1(PROP2YN1YL)13DIHYDRO2HINDOL2ONE
5BROMO3(2(34DIMETHOXYPHENYL)2OXOETHYL)3HYDROXY1PROP2YNYLINDOL2ONE
C#CCN1c2ccc(cc2C(C1=O)(O)CC(=O)c1ccc(c(c1)OC)OC)Br
COC1=C(C=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#C)O)OC
InChI=1SC21H18BrNO5c14923167614(22)1115(16)21(2620(23)25)1217(24)135818(272)19(1013)283h158101126H912H223H3
MFCD03720866
STK051847
ZINC000002488744
ZINC000002488746
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