Vitas-M small molecule compound
2-chloro-5-(5-{(Z)-[1-(3,5-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK605333
SMILES Cc1cc(C)cc(c1)N1C(=O)N=C(/C(=C/c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C1=O)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 C24H17ClN2O6 MW 464.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O6/c1-12-7-13(2)9-15(8-12)27-22(29)18(21(28)26-24(27)32)11-16-4-6-20(33-16)14-3-5-19(25)17(10-14)23(30)31/h3-11H,1-2H3,(H,30,31)(H,26,28,32)/b18-11-InChIKey
KYDIALMWTSAEFZ-WQRHYEAKSA-NSynonyms
2CHLORO5(5((Z)(1(35DIMETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2chloro5(5((Z)(1(35dimethylphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
Cc1cc(C)cc(c1)N1C(=O)N=C(C(=Cc2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)C1=O)O
InChI=1SC24H17ClN2O6c112713(2)915(812)2722(29)18(21(28)2624(27)32)11164620(3316)143519(25)17(1014)23(30)31h311H12H3(H3031)(H262832)b1811
MFCD08729328
ZINC000009310901
ZINC9310901
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