Vitas-M small molecule compound
5-bromo-1-ethyl-3-[(3E)-4-(furan-2-yl)-2-oxobut-3-en-1-yl]-3-hydroxy-1,3-dihydro-2H-indol-2-one
Catalog ID
STK216915
SMILES CCN1c2ccc(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 C18H16BrNO4 MW 390.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrNO4/c1-2-20-16-8-5-12(19)10-15(16)18(23,17(20)22)11-13(21)6-7-14-4-3-9-24-14/h3-10,23H,2,11H2,1H3/b7-6+InChIKey
XSAHDRPUTVTXEY-VOTSOKGWSA-NSynonyms
3((3E)4(2FURYL)2OXOBUT3ENYL)5BROMO1ETHYL3HYDROXYINDOLIN2ONE
5bromo1ethyl3((3E)4(furan2yl)2oxobut3en1yl)3hydroxy13dihydro2Hindol2one
5BROMO1ETHYL3((E)4(FURAN2YL)2OXOBUT3ENYL)3HYDROXYINDOL2ONE
CCN1C2=C(C=C(C=C2)Br)C(C1=O)(CC(=O)C=CC3=CC=CO3)O
CCN1c2ccc(cc2C(C1=O)(O)CC(=O)C=Cc1ccco1)Br
InChI=1SC18H16BrNO4c1220168512(19)1015(16)18(2317(20)22)1113(21)67144392414h31023H211H21H3b76+
MFCD03837401
ZINC000004555020
ZINC000004555021
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