Vitas-M small molecule compound
4-[(4-{(E)-[1-(4-ethoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)methyl]benzoic acid
Catalog ID
STK177164
SMILES CCOc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)OC)OCc2ccc(cc2)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 C28H24N2O8 MW 516.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O8/c1-3-37-21-11-9-20(10-12-21)30-26(32)22(25(31)29-28(30)35)14-18-6-13-23(24(15-18)36-2)38-16-17-4-7-19(8-5-17)27(33)34/h4-15H,3,16H2,1-2H3,(H,33,34)(H,29,31,35)/b22-14+InChIKey
QCBHAWLEZVMIGI-HYARGMPZSA-NSynonyms
4((4((E)(1(4ethoxyphenyl)246trioxo13diazinan5ylidene)methyl)2methoxyphenoxy)methyl)benzoicacid
4((4((E)(1(4ETHOXYPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)C(=O)O)OC)C(=O)NC2=O
CCOc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)OC)OCc2ccc(cc2)C(=O)O)C1=O
InChI=1SC28H24N2O8c13372111920(101221)3026(32)22(25(31)2928(30)35)141861323(24(1518)362)3816174719(8517)27(33)34h415H316H212H3(H3334)(H293135)b2214+
MFCD02085139
ZINC000009310771
ZINC9310771
Check stock
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