Vitas-M small molecule compound
3-(5-{(Z)-[1-(4-ethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK712441
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)C(=O)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 C24H18N2O6 MW 430.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O6/c1-2-14-6-8-17(9-7-14)26-22(28)19(21(27)25-24(26)31)13-18-10-11-20(32-18)15-4-3-5-16(12-15)23(29)30/h3-13H,2H2,1H3,(H,29,30)(H,25,27,31)/b19-13-InChIKey
ZAOPLYDDMFMYON-UYRXBGFRSA-NSynonyms
799791-21-2(Z)3(5((1(4ethylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
3(5((Z)(1(4ETHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
3(5((Z)(1(4ethylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
799791212
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(=O)O)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(o2)c2cccc(c2)C(=O)O)C1=O
InChI=1SC24H18N2O6c12146817(9714)2622(28)19(21(27)2524(26)31)1318101120(3218)1543516(1215)23(29)30h313H2H21H3(H2930)(H252731)b1913
MFCD03676240
ZINC000020171736
ZINC20171736
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