Vitas-M small molecule compound
ethyl (4-{(E)-[1-(1,3-benzodioxol-5-yl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-chloro-6-ethoxyphenoxy)acetate
Catalog ID
STK018235
SMILES CCOC(=O)COc1c(Cl)cc(cc1OCC)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc2c(c1)OCO2
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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 C24H21ClN2O9 MW 516.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2O9/c1-3-32-19-9-13(8-16(25)21(19)34-11-20(28)33-4-2)7-15-22(29)26-24(31)27(23(15)30)14-5-6-17-18(10-14)36-12-35-17/h5-10H,3-4,11-12H2,1-2H3,(H,26,29,31)/b15-7+InChIKey
DUXQTROVEYODAI-VIZOYTHASA-NSynonyms
CCOC(=O)COc1c(Cl)cc(cc1OCC)C=C1C(=O)NC(=O)N(C1=O)c1ccc2c(c1)OCO2
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC4=C(C=C3)OCO4)Cl)OCC(=O)OCC
ETHYL(4((E)(1(13BENZODIOXOL5YL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2CHLORO6ETHOXYPHENOXY)ACETATE
ETHYL2(4((E)(1(13BENZODIOXOL5YL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)2CHLORO6ETHOXYPHENOXY)ACETATE
InChI=1SC24H21ClN2O9c133219913(816(25)21(19)341120(28)3342)71522(29)2624(31)27(23(15)30)14561718(1014)36123517h510H341112H212H3(H262931)b157+
MFCD03241532
STK018235
ZINC000008993708
ZINC08993708
ZINC8993708
Check stock
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Check stock on Vitas-MAvailable files
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