Vitas-M small molecule compound
(E)-(3-chloro-4-methoxyphenyl){2-(2-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL038263
SMILES COc1ccccc1C1/C(=C(/c2ccc(c(c2)Cl)OC)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1
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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/c1-32-19-6-4-3-5-17(19)22-21(23(29)16-7-8-20(33-2)18(26)15-16)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
KBIGUQIGPNHWDL-XTQSDGFTSA-NSynonyms
636990-87-9(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)5(2METHOXYPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(2(2methoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(2(2METHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(2METHOXYPHENYL)1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
636990879
COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=CC=C4OC)O)Cl
COc1ccccc1C1C(=C(c2ccc(c(c2)Cl)OC)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
InChI=1SC25H27ClN2O6c13219643517(19)2221(23(29)167820(332)18(26)1516)24(30)25(31)28(22)10927111334141227h38152229H914H212H3b2321+
MFCD18247588
ZINC000008905096
ZINC000008905099
Check stock
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Check stock on Vitas-MAvailable files
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