Vitas-M small molecule compound
(1Z,2E)-1-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Catalog ID
STK590946
SMILES [O-]/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)CCC[NH+]1CCOCC1)/C=C/c1ccccc1
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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c29-21(10-9-19-6-2-1-3-7-19)22-23(20-8-4-11-26-18-20)28(25(31)24(22)30)13-5-12-27-14-16-32-17-15-27/h1-4,6-11,18,23,29H,5,12-17H2/b10-9+,22-21-InChIKey
IDRWPOYCXUOIHA-VABNVEPGSA-NSynonyms
(1Z2E)1(1(3(morpholin4ium4yl)propyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)3phenylprop2en1olate
(O)C(=C1C(=O)C(=O)N(C1c1cccnc1)CCC(NH+)1CCOCC1)C=Cc1ccccc1
MFCD07201044
ZINC000102607864
ZINC000102674859
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