Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STK565781
SMILES C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC
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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 C28H34N2O4 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O4/c1-5-18-34-23-11-8-10-22(19-23)25-24(26(31)21-14-12-20(4)13-15-21)27(32)28(33)30(25)17-9-16-29(6-2)7-3/h5,8,10-15,19,25,31H,1,6-7,9,16-18H2,2-4H3/b26-24+InChIKey
LWNRLBJTFWYYQR-SHHOIMCASA-NSynonyms
619276-50-5(4E)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)45dioxo2(3(prop2en1yloxy)phenyl)pyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXO2(3PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
619276505
C=CCOc1cccc(c1)C1C(=C(c2ccc(cc2)C)(O))C(=O)C(=O)N1CCC(NH+)(CC)CC
CCN(CC)CCCN1C(C(=C(C2=CC=C(C=C2)C)O)C(=O)C1=O)C3=CC(=CC=C3)OCC=C
InChI=1SC28H34N2O4c151834231181022(1923)2524(26(31)21141220(4)131521)27(32)28(33)30(25)1791629(62)73h581015192531H16791618H224H3b2624+
MFCD18244870
ZINC000101313311
ZINC000101313314
Check stock
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Check stock on Vitas-MAvailable files
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