Vitas-M small molecule compound
5-bromo-2-{5-[(Z)-{1-[4-(ethoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl]furan-2-yl}benzoic acid
Catalog ID
STK017424
SMILES CCOC(=O)c1ccc(cc1)N1NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2C(=O)O)Br)/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 C24H17BrN2O7 MW 525.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrN2O7/c1-2-33-24(32)13-3-6-15(7-4-13)27-22(29)19(21(28)26-27)12-16-8-10-20(34-16)17-9-5-14(25)11-18(17)23(30)31/h3-12H,2H2,1H3,(H,26,28)(H,30,31)/b19-12-InChIKey
FQJOGTZGTMSFHO-UNOMPAQXSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)Br)C(=O)O)C(=O)N2
CCOC(=O)c1ccc(cc1)N1NC(=O)C(=Cc2ccc(o2)c2ccc(cc2C(=O)O)Br)C1=O
InChI=1SC24H17BrN2O7c123324(32)133615(7413)2722(29)19(21(28)2627)121681020(3416)179514(25)1118(17)23(30)31h312H2H21H3(H2628)(H3031)b1912
MFCD03079718
STK017424
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