Vitas-M small molecule compound
ethyl (3-{(E)-[1-(1,3-benzodioxol-5-yl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)acetate
Catalog ID
STK622775
SMILES CCOC(=O)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)c1ccc2c(c1)OCO2)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 C24H19N3O7 MW 461.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O7/c1-2-32-21(28)12-26-11-14(16-5-3-4-6-18(16)26)9-17-22(29)25-24(31)27(23(17)30)15-7-8-19-20(10-15)34-13-33-19/h3-11H,2,12-13H2,1H3,(H,25,29,31)/b17-9+InChIKey
RHKKBQIVEYJOMG-RQZCQDPDSA-NSynonyms
CCOC(=O)Cn1cc(c2c1cccc2)C=C1C(=NC(=O)N(C1=O)c1ccc2c(c1)OCO2)O
ethyl(3((E)(1(13benzodioxol5yl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)1Hindol1yl)acetate
ETHYL2(3((1(2HBENZO(34D)13DIOXOLAN5YL)246TRIOXO13DIHYDROPYRIMIDIN5YLIDENE)METHYL)INDOLYL)ACETATE
ETHYL2(3((E)(1(13BENZODIOXOL5YL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)INDOL1YL)ACETATE
InChI=1SC24H19N3O7c123221(28)12261114(16534618(16)26)91722(29)2524(31)27(23(17)30)15781920(1015)34133319h311H21213H21H3(H252931)b179+
MFCD09790414
ZINC000013551904
ZINC13551904
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