Vitas-M small molecule compound
5-bromo-3-hydroxy-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK054948
SMILES C#CCN1c2ccc(cc2C(C1=O)(O)CC(=O)c1ccc(cc1)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 C20H16BrNO4 MW 414.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrNO4/c1-3-10-22-17-9-6-14(21)11-16(17)20(25,19(22)24)12-18(23)13-4-7-15(26-2)8-5-13/h1,4-9,11,25H,10,12H2,2H3InChIKey
NKHOPOWAOIHKBP-UHFFFAOYSA-NSynonyms
(3S)5BROMO3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)1(PROP2YN1YL)13DIHYDRO2HINDOL2ONE
5BROMO3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)1(2PROPYNYL)13DIHYDRO2HINDOL2ONE
5BROMO3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)1(PROP2YN1YL)13DIHYDRO2HINDOL2ONE
5BROMO3HYDROXY3(2(4METHOXYPHENYL)2OXOETHYL)1PROP2YNYLINDOL2ONE
C#CCN1c2ccc(cc2C(C1=O)(O)CC(=O)c1ccc(cc1)OC)Br
COC1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)CC#C)O
InChI=1SC20H16BrNO4c131022179614(21)1116(17)20(2519(22)24)1218(23)134715(262)8513h1491125H1012H22H3
MFCD03721354
STK054948
ZINC000001131049
ZINC000001131050
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