Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STK561737
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OCC)CC[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 C26H30N2O5 MW 450.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O5/c1-5-17-33-21-13-9-19(10-14-21)24(29)22-23(18-7-11-20(12-8-18)32-6-2)28(16-15-27(3)4)26(31)25(22)30/h5,7-14,23,29H,1,6,15-17H2,2-4H3/b24-22+InChIKey
HUTQADDRVCTMBG-ZNTNEXAZSA-NSynonyms
845805-97-2(4E)1(2DIMETHYLAMINOETHYL)5(4ETHOXYPHENYL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(4ethoxyphenyl)45dioxopyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)5(4ETHOXYPHENYL)3HYDROXY4((4PROP2ENYLOXYPHENYL)CARBONYL)3PYRROLIN2ONE
845805972
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)OCC)CC(NH+)(C)C)(O)
CCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC=C)(O))C(=O)C(=O)N2CC(NH+)(C)C
InChI=1SC26H30N2O5c1517332113919(101421)24(29)2223(1871120(12818)3262)28(161527(3)4)26(31)25(22)30h57142329H161517H224H3b2422+
MFCD18243874
ZINC000009122089
ZINC000009179076
Check stock
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Check stock on Vitas-MAvailable files
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