Vitas-M small molecule compound
(E)-(4-chlorophenyl){1-[2-(diethylammonio)ethyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK565057
SMILES COc1cccc(c1)C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/[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 C24H27ClN2O4 MW 442.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O4/c1-4-26(5-2)13-14-27-21(17-7-6-8-19(15-17)31-3)20(23(29)24(27)30)22(28)16-9-11-18(25)12-10-16/h6-12,15,21,28H,4-5,13-14H2,1-3H3/b22-20+InChIKey
KYWJDSZNLHIZCW-LSDHQDQOSA-NSynonyms
615272-62-3(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(2DIETHYLAMINOETHYL)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(4chlorophenyl)(1(2(diethylammonio)ethyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4CHLOROPHENYL)(1(2(DIETHYLAZANIUMYL)ETHYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)4((4CHLOROPHENYL)CARBONYL)3HYDROXY5(3METHOXYPHENYL)3PYRROLIN2ONE
615272623
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)Cl)(O))C(=O)C1=O)C3=CC(=CC=C3)OC
COc1cccc(c1)C1N(CC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1ccc(cc1)Cl)(O)
InChI=1SC24H27ClN2O4c1426(52)13142721(1776819(1517)313)20(23(29)24(27)30)22(28)1691118(25)121016h612152128H451314H213H3b2220+
MFCD18244679
ZINC000009007878
ZINC000009007879
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.