Vitas-M small molecule compound
(E)-(3-chloro-4-methoxyphenyl){1-[3-(dimethylammonio)propyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL150773
SMILES COc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCC[NH+](C)C)/[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 C22H25ClN2O5 MW 432.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O5/c1-13-6-8-17(30-13)19-18(20(26)14-7-9-16(29-4)15(23)12-14)21(27)22(28)25(19)11-5-10-24(2)3/h6-9,12,19,26H,5,10-11H2,1-4H3/b20-18+InChIKey
NNKHEQQGXMUUAR-CZIZESTLSA-NSynonyms
636987-36-5(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(5METHYLFURAN2YL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(3(dimethylammonio)propyl)2(5methylfuran2yl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(5METHYLFURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(5METHYL(2FURYL))3PYRROLIN2ONE
636987365
CC1=CC=C(O1)C2C(=C(C3=CC(=C(C=C3)OC)Cl)O)C(=O)C(=O)N2CCCN(C)C
COc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1ccc(o1)C)CCC(NH+)(C)C)(O)
InChI=1SC22H25ClN2O5c1136817(3013)1918(20(26)147916(294)15(23)1214)21(27)22(28)25(19)1151024(2)3h69121926H51011H214H3b2018+
MFCD20755901
ZINC000102931812
ZINC000102931814
Check stock
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Check stock on Vitas-MAvailable files
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