Vitas-M small molecule compound
methyl {4-[(E)-(1-cyclohexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-ethoxyphenoxy}acetate
Catalog ID
STK213557
SMILES CCOc1cc(ccc1OCC(=O)OC)/C=C/1\C(=O)NC(=O)N(C1=O)C1CCCCC1
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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 C22H26N2O7 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O7/c1-3-30-18-12-14(9-10-17(18)31-13-19(25)29-2)11-16-20(26)23-22(28)24(21(16)27)15-7-5-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,23,26,28)/b16-11+InChIKey
ZZLQBUJJHOGVLX-LFIBNONCSA-NSynonyms
5453-63-45453634
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)OCC(=O)OC
CCOc1cc(ccc1OCC(=O)OC)C=C1C(=O)NC(=O)N(C1=O)C1CCCCC1
InChI=1SC22H26N2O7c1330181214(91017(18)311319(25)292)111620(26)2322(28)24(21(16)27)157546815h91215H3813H212H3(H232628)b1611+
METHYL(4((E)(1CYCLOHEXYL246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2ETHOXYPHENOXY)ACETATE
METHYL2(4((E)(1CYCLOHEXYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)2ETHOXYPHENOXY)ACETATE
MFCD05821774
ZINC000012868201
ZINC12868201
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