Vitas-M small molecule compound
(E)-{2-(2,4-dichlorophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Catalog ID
STL149048
SMILES COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1Cl)Cl)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 C24H26Cl2N2O4 MW 477.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26Cl2N2O4/c1-14-12-16(32-4)7-9-17(14)22(29)20-21(18-8-6-15(25)13-19(18)26)28(24(31)23(20)30)11-5-10-27(2)3/h6-9,12-13,21,29H,5,10-11H2,1-4H3/b22-20+InChIKey
YBVKMFNNZSUTRT-LSDHQDQOSA-NSynonyms
(4E)5(24DICHLOROPHENYL)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(24dichlorophenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(4methoxy2methylphenyl)methanolate
(E)(2(24DICHLOROPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXY2METHYLPHENYL)METHANOLATE
CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)CCC(NH+)(C)C)C3=C(C=C(C=C3)Cl)Cl)(O)
COc1ccc(c(c1)C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1Cl)Cl)CCC(NH+)(C)C)(O)
InChI=1SC24H26Cl2N2O4c1141216(324)7917(14)22(29)2021(188615(25)1319(18)26)28(24(31)23(20)30)1151027(2)3h6912132129H51011H214H3b2220+
MFCD20755524
ZINC000102928734
ZINC000102928736
Check stock
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Check stock on Vitas-MAvailable files
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