Vitas-M small molecule compound
4-{(3E)-2-(4-bromophenyl)-3-[hydroxy(4-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}butanoic acid
Catalog ID
STL038291
SMILES OC(=O)CCCN1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O
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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 C22H20BrNO5 MW 458.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO5/c1-13-4-6-15(7-5-13)20(27)18-19(14-8-10-16(23)11-9-14)24(22(29)21(18)28)12-2-3-17(25)26/h4-11,19,27H,2-3,12H2,1H3,(H,25,26)/b20-18+InChIKey
ANYVERMSGKFWJL-CZIZESTLSA-NSynonyms
4((3E)2(4bromophenyl)3(hydroxy(4methylphenyl)methylidene)45dioxopyrrolidin1yl)butanoicacid
4(2(4BROMOPHENYL)4HYDROXY3(4METHYLBENZOYL)5OXO25DIHYDRO1HPYRROL1YL)BUTANOICACID
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCC(=O)O)C3=CC=C(C=C3)Br)O
InChI=1SC22H20BrNO5c1134615(7513)20(27)1819(1481016(23)11914)24(22(29)21(18)28)122317(25)26h4111927H2312H21H3(H2526)b2018+
MFCD03801561
OC(=O)CCCN1C(c2ccc(cc2)Br)C(=C(c2ccc(cc2)C)O)C(=O)C1=O
ZINC000102861408
ZINC000102861413
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