Vitas-M small molecule compound
(E)-(3-chloro-4-methoxyphenyl){2-(4-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL038607
SMILES COc1ccc(cc1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)Cl)OC)/[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 C25H27ClN2O6 MW 486.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27ClN2O6/c1-32-18-6-3-16(4-7-18)22-21(23(29)17-5-8-20(33-2)19(26)15-17)24(30)25(31)28(22)10-9-27-11-13-34-14-12-27/h3-8,15,22,29H,9-14H2,1-2H3/b23-21+InChIKey
WGBBEOBWEOXSTL-XTQSDGFTSA-NSynonyms
636990-83-5(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)5(4METHOXYPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(2(4methoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(2(4METHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(4METHOXYPHENYL)1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
636990835
COC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)Cl)(O))C(=O)C(=O)N2CC(NH+)4CCOCC4
COc1ccc(cc1)C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(c(c1)Cl)OC)(O)
InChI=1SC25H27ClN2O6c132186316(4718)2221(23(29)175820(332)19(26)1517)24(30)25(31)28(22)10927111334141227h38152229H914H212H3b2321+
MFCD18247666
ZINC000008897886
ZINC000008897896
Check stock
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Check stock on Vitas-MAvailable files
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