Vitas-M small molecule compound
ethyl 4-{(3E)-2-(4-bromophenyl)-3-[(4-chlorophenyl)(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoate
Catalog ID
STK593846
SMILES CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\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 C26H19BrClNO5 MW 540.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19BrClNO5/c1-2-34-26(33)17-7-13-20(14-8-17)29-22(15-3-9-18(27)10-4-15)21(24(31)25(29)32)23(30)16-5-11-19(28)12-6-16/h3-14,22,30H,2H2,1H3/b23-21+InChIKey
VANZAGWJSKULGX-XTQSDGFTSA-NSynonyms
497943-06-3497943063
CCOC(=O)C1=CC=C(C=C1)N2C(C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C2=O)C4=CC=C(C=C4)Br
CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)Br)C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O
ethyl4((3E)2(4bromophenyl)3((4chlorophenyl)(hydroxy)methylidene)45dioxopyrrolidin1yl)benzoate
ETHYL4((3E)2(4BROMOPHENYL)3((4CHLOROPHENYL)HYDROXYMETHYLIDENE)45DIOXOPYRROLIDIN1YL)BENZOATE
InChI=1SC26H19BrClNO5c123426(33)1771320(14817)2922(153918(27)10415)21(24(31)25(29)32)23(30)1651119(28)12616h3142230H2H21H3b2321+
MFCD07199621
ZINC000102613404
ZINC000102613413
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