Vitas-M small molecule compound
(E)-(3-chloro-4-ethoxyphenyl){1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate
Catalog ID
STK566779
SMILES CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)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 C24H27ClN2O4 MW 442.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O4/c1-4-31-19-12-11-17(15-18(19)25)22(28)20-21(16-9-6-5-7-10-16)27(24(30)23(20)29)14-8-13-26(2)3/h5-7,9-12,15,21,28H,4,8,13-14H2,1-3H3/b22-20+InChIKey
OKGVQKXDGDFSBJ-LSDHQDQOSA-NSynonyms
636988-65-3(4E)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5PHENYLPYRROLIDINE23DIONE
(E)(3chloro4ethoxyphenyl)(1(3(dimethylammonio)propyl)45dioxo2phenylpyrrolidin3ylidene)methanolate
(E)(3CHLORO4ETHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4ETHOXYPHENYL)CARBONYL)3HYDROXY5PHENYL3PYRROLIN2ONE
636988653
CCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC=CC=C3)O)Cl
CCOc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1ccccc1)CCC(NH+)(C)C)(O)
InChI=1SC24H27ClN2O4c143119121117(1518(19)25)22(28)2021(1696571016)27(24(30)23(20)29)1481326(2)3h57912152128H481314H213H3b2220+
MFCD18245100
ZINC000102543917
ZINC000102543923
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.