Vitas-M small molecule compound
methyl 4-(5-{(E)-[4-hydroxy-1-(4-methylphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoate
Catalog ID
STL037675
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C)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 C24H18N2O6 MW 430.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O6/c1-14-3-9-17(10-4-14)26-22(28)19(21(27)25-24(26)30)13-18-11-12-20(32-18)15-5-7-16(8-6-15)23(29)31-2/h3-13H,1-2H3,(H,25,27,30)/b19-13+InChIKey
IQAZASMAGKVZAI-CPNJWEJPSA-NSynonyms
340799-07-7340799077
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C(=O)OC)C(=O)NC2=O
COC(=O)c1ccc(cc1)c1ccc(o1)C=C1C(=NC(=O)N(C1=O)c1ccc(cc1)C)O
InChI=1SC24H18N2O6c1143917(10414)2622(28)19(21(27)2524(26)30)1318111220(3218)155716(8615)23(29)312h313H12H3(H252730)b1913+
METHYL4(5((E)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOATE
methyl4(5((E)(4hydroxy1(4methylphenyl)26dioxo16dihydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoate
MFCD04079746
ZINC000002382091
ZINC2382091
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