Vitas-M small molecule compound
4-{(3E)-2-(4-bromophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}butanoic acid
Catalog ID
STK562420
SMILES OC(=O)CCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)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 C21H18BrNO5 MW 444.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO5/c22-15-10-8-13(9-11-15)18-17(19(26)14-5-2-1-3-6-14)20(27)21(28)23(18)12-4-7-16(24)25/h1-3,5-6,8-11,18,26H,4,7,12H2,(H,24,25)/b19-17+InChIKey
IDMOOUSEWBNUML-HTXNQAPBSA-NSynonyms
370587-07-8370587078
4((3E)2(4bromophenyl)3(hydroxy(phenyl)methylidene)45dioxopyrrolidin1yl)butanoicacid
4(3BENZOYL2(4BROMOPHENYL)4HYDROXY5OXO25DIHYDRO1HPYRROL1YL)BUTANOICACID
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCC(=O)O)C3=CC=C(C=C3)Br)O
InChI=1SC21H18BrNO5c221510813(91115)1817(19(26)145213614)20(27)21(28)23(18)124716(24)25h13568111826H4712H2(H2425)b1917+
MFCD03817778
OC(=O)CCCN1C(=O)C(=O)C(=C(c2ccccc2)O)C1c1ccc(cc1)Br
ZINC000102512403
ZINC000102512412
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