Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL151064
SMILES C[NH+](CCN1C(c2ccncc2)/C(=C(/c2ccccc2)\[O-])/C(=O)C1=O)C
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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 C20H21N3O3 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3/c1-22(2)12-13-23-17(14-8-10-21-11-9-14)16(19(25)20(23)26)18(24)15-6-4-3-5-7-15/h3-11,17,24H,12-13H2,1-2H3/b18-16+InChIKey
UGXIILQOJHPHIT-FBMGVBCBSA-NSynonyms
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(PHENYL)METHYLIDENE)5PYRIDIN4YLPYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(pyridin4yl)pyrrolidin3ylidene)(phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2PYRIDIN4YLPYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
C(NH+)(C)CCN1C(C(=C(C2=CC=CC=C2)(O))C(=O)C1=O)C3=CC=NC=C3
C(NH+)(CCN1C(c2ccncc2)C(=C(c2ccccc2)(O))C(=O)C1=O)C
InChI=1SC20H21N3O3c122(2)12132317(148102111914)16(19(25)20(23)26)18(24)156435715h3111724H1213H212H3b1816+
MFCD20755964
ZINC000004312210
ZINC000004312211
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