Vitas-M small molecule compound
4-methyl-3-(5-{(E)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK710297
SMILES Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(o2)c2cc(ccc2C)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/c1-13-3-7-16(8-4-13)26-22(28)19(21(27)25-24(26)31)12-17-9-10-20(32-17)18-11-15(23(29)30)6-5-14(18)2/h3-12H,1-2H3,(H,29,30)(H,25,27,31)/b19-12+InChIKey
VKLQENKPIXWDGP-XDHOZWIPSA-NSynonyms
(Z)4methyl3(5((246trioxo1(ptolyl)tetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
4METHYL3(5((E)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
4methyl3(5((E)(1(4methylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)C)C(=O)NC2=O
Cc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(o2)c2cc(ccc2C)C(=O)O)C1=O
InChI=1SC24H18N2O6c1133716(8413)2622(28)19(21(27)2524(26)31)121791020(3217)181115(23(29)30)6514(18)2h312H12H3(H2930)(H252731)b1912+
MFCD02916679
ZINC000015745861
ZINC15745861
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