Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STK559586
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)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 C28H36N2O4 MW 464.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O4/c1-6-18-34-23-14-12-22(13-15-23)26(31)24-25(21-10-8-20(9-11-21)19(2)3)30(28(33)27(24)32)17-7-16-29(4)5/h8-15,19,25,31H,6-7,16-18H2,1-5H3/b26-24+InChIKey
CGVNQXBKKZVZSU-SHHOIMCASA-NSynonyms
615275-93-9(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(4PROPAN2YLPHENYL)PYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(4(METHYLETHYL)PHENYL)4((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615275939
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)(C)C)C3=CC=C(C=C3)C(C)C)(O)
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CCC(NH+)(C)C)(O)
InChI=1SC28H36N2O4c16183423141222(131523)26(31)2425(2110820(91121)19(2)3)30(28(33)27(24)32)1771629(4)5h815192531H671618H215H3b2624+
MFCD18243311
ZINC000102488510
ZINC000102488520
Check stock
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Check stock on Vitas-MAvailable files
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