Vitas-M small molecule compound
(E)-{2-(3,4-dichlorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(3,4-dimethoxyphenyl)methanolate
Catalog ID
STL038719
SMILES COc1cc(ccc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CC[NH+]1CCOCC1)/[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 C25H26Cl2N2O6 MW 521.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26Cl2N2O6/c1-33-19-6-4-16(14-20(19)34-2)23(30)21-22(15-3-5-17(26)18(27)13-15)29(25(32)24(21)31)8-7-28-9-11-35-12-10-28/h3-6,13-14,22,30H,7-12H2,1-2H3/b23-21+InChIKey
JKUFCWGMZYBJNZ-XTQSDGFTSA-NSynonyms
636992-07-9(4E)5(34DICHLOROPHENYL)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(34dichlorophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(34dimethoxyphenyl)methanolate
(E)(2(34DICHLOROPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(34DIMETHOXYPHENYL)METHANOLATE
5(34DICHLOROPHENYL)4((34DIMETHOXYPHENYL)CARBONYL)3HYDROXY1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
636992079
COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC(=C(C=C4)Cl)Cl)O)OC
COc1cc(ccc1OC)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CC(NH+)1CCOCC1)(O)
InChI=1SC25H26Cl2N2O6c133196416(1420(19)342)23(30)2122(153517(26)18(27)1315)29(25(32)24(21)31)872891135121028h3613142230H712H212H3b2321+
MFCD18247691
ZINC000102862523
ZINC000102862525
Check stock
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Check stock on Vitas-MAvailable files
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