Vitas-M small molecule compound
N-{2-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(2,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-1-yl]ethyl}acetamide
Catalog ID
STL052739
SMILES COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1CCNC(=O)C
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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 C23H23ClN2O6 MW 458.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN2O6/c1-13(27)25-10-11-26-20(17-9-8-16(31-2)12-18(17)32-3)19(22(29)23(26)30)21(28)14-4-6-15(24)7-5-14/h4-9,12,20,28H,10-11H2,1-3H3,(H,25,27)/b21-19+InChIKey
CMNPLEJQTGOPLE-XUTLUUPISA-NSynonyms
488826-20-6488826206
CC(=O)NCCN1C(C(=C(C2=CC=C(C=C2)Cl)O)C(=O)C1=O)C3=C(C=C(C=C3)OC)OC
COc1ccc(c(c1)OC)C1C(=C(c2ccc(cc2)Cl)O)C(=O)C(=O)N1CCNC(=O)C
InChI=1SC23H23ClN2O6c113(27)2510112620(179816(312)1218(17)323)19(22(29)23(26)30)21(28)144615(24)7514h49122028H1011H213H3(H2527)b2119+
MFCD05725746
N(2((3E)3((4chlorophenyl)(hydroxy)methylidene)2(24dimethoxyphenyl)45dioxopyrrolidin1yl)ethyl)acetamide
N(2((3E)3((4CHLOROPHENYL)HYDROXYMETHYLIDENE)2(24DIMETHOXYPHENYL)45DIOXOPYRROLIDIN1YL)ETHYL)ACETAMIDE
ZINC000102890608
ZINC000102890610
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