Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Catalog ID
STL149667
SMILES CCOc1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCC(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 C28H36N2O5 MW 480.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O5/c1-7-34-22-11-8-20(9-12-22)25-24(27(32)28(33)30(25)15-14-29(5)6)26(31)21-10-13-23(19(4)16-21)35-17-18(2)3/h8-13,16,18,25,31H,7,14-15,17H2,1-6H3/b26-24+InChIKey
NRGNKHQMSUSWNM-SHHOIMCASA-NSynonyms
488801-50-9(4E)1(2(dimethylamino)ethyl)5(4ethoxyphenyl)4(hydroxy(3methyl4(2methylpropoxy)phenyl)methylidene)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)5(4ETHOXYPHENYL)4(HYDROXY(3METHYL4(2METHYLPROPOXY)PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(4ethoxyphenyl)45dioxopyrrolidin3ylidene)(3methyl4(2methylpropoxy)phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHYL4(2METHYLPROPOXY)PHENYL)METHANOLATE
488801509
CCOC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OCC(C)C)C)O)C(=O)C(=O)N2CCN(C)C
CCOc1ccc(cc1)C1N(CC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(c(c1)C)OCC(C)C)(O)
InChI=1SC28H36N2O5c17342211820(91222)2524(27(32)28(33)30(25)151429(5)6)26(31)21101323(19(4)1621)351718(2)3h81316182531H7141517H216H3b2624+
MFCD20755650
ZINC000102929506
ZINC000102929509
Check stock
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Check stock on Vitas-MAvailable files
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