Vitas-M small molecule compound
5-bromo-1-butyl-3-hydroxy-3-[(3Z)-2-oxo-4-phenylbut-3-en-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK214575
SMILES CCCCN1c2ccc(cc2C(C1=O)(O)CC(=O)/C=C\c1ccccc1)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 C22H22BrNO3 MW 428.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrNO3/c1-2-3-13-24-20-12-10-17(23)14-19(20)22(27,21(24)26)15-18(25)11-9-16-7-5-4-6-8-16/h4-12,14,27H,2-3,13,15H2,1H3/b11-9-InChIKey
AFEFWJLNMABZBO-LUAWRHEFSA-NSynonyms
3((3Z)2OXO4PHENYLBUT3ENYL)5BROMO1BUTYL3HYDROXYINDOLIN2ONE
5BROMO1BUTYL3HYDROXY3((3Z)2OXO4PHENYLBUT3EN1YL)13DIHYDRO2HINDOL2ONE
5bromo1butyl3hydroxy3((Z)2oxo4phenylbut3enyl)indol2one
5BROMO1BUTYL3HYDROXY3(2OXO4PHENYL3BUTENYL)13DIHYDRO2HINDOL2ONE
CCCCN1C2=C(C=C(C=C2)Br)C(C1=O)(CC(=O)C=CC3=CC=CC=C3)O
CCCCN1c2ccc(cc2C(C1=O)(O)CC(=O)C=Cc1ccccc1)Br
InChI=1SC22H22BrNO3c123132420121017(23)1419(20)22(2721(24)26)1518(25)119167546816h4121427H231315H21H3b119
MFCD03836597
ZINC000008920277
ZINC000008920282
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