Vitas-M small molecule compound
5-bromo-1-butyl-3-[(3E)-4-(furan-2-yl)-2-oxobut-3-en-1-yl]-3-hydroxy-1,3-dihydro-2H-indol-2-one
Catalog ID
STK214576
SMILES CCCCN1c2ccc(cc2C(C1=O)(O)CC(=O)/C=C/c1ccco1)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 C20H20BrNO4 MW 418.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrNO4/c1-2-3-10-22-18-9-6-14(21)12-17(18)20(25,19(22)24)13-15(23)7-8-16-5-4-11-26-16/h4-9,11-12,25H,2-3,10,13H2,1H3/b8-7+InChIKey
RYKGEGBUIHNFRG-BQYQJAHWSA-NSynonyms
688040-17-73((3E)4(2FURYL)2OXOBUT3ENYL)5BROMO1BUTYL3HYDROXYINDOLIN2ONE
5BROMO1BUTYL3((3E)4(FURAN2YL)2OXOBUT3EN1YL)3HYDROXY13DIHYDRO2HINDOL2ONE
5BROMO1BUTYL3((E)4(FURAN2YL)2OXOBUT3ENYL)3HYDROXYINDOL2ONE
688040177
CCCCN1C2=C(C=C(C=C2)Br)C(C1=O)(CC(=O)C=CC3=CC=CO3)O
CCCCN1c2ccc(cc2C(C1=O)(O)CC(=O)C=Cc1ccco1)Br
InChI=1SC20H20BrNO4c1231022189614(21)1217(18)20(2519(22)24)1315(23)781654112616h49111225H231013H21H3b87+
MFCD03835924
ZINC000004554115
ZINC000004554117
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