Vitas-M small molecule compound
(E)-[4,5-dioxo-1-(pyridinium-2-yl)-2-(pyridin-3-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Catalog ID
STL039378
SMILES [O-]/C(=C/1\C(c2cccnc2)N(C(=O)C1=O)c1cccc[nH+]1)/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 C21H15N3O3 MW 357.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O3/c25-19(14-7-2-1-3-8-14)17-18(15-9-6-11-22-13-15)24(21(27)20(17)26)16-10-4-5-12-23-16/h1-13,18,25H/b19-17+InChIKey
LCWRBNOTWODFOD-HTXNQAPBSA-NSynonyms
332125-56-1(4E)4(HYDROXY(PHENYL)METHYLIDENE)1PYRIDIN2YL5PYRIDIN3YLPYRROLIDINE23DIONE
(E)(45dioxo1(pyridinium2yl)2(pyridin3yl)pyrrolidin3ylidene)(phenyl)methanolate
(O)C(=C1C(c2cccnc2)N(C(=O)C1=O)c1cccc(nH+)1)c1ccccc1
332125561
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=CC=CC=N3)C4=CN=CC=C4)O
InChI=1SC21H15N3O3c2519(147213814)1718(159611221315)24(21(27)20(17)26)161045122316h1131825Hb1917+
MFCD18247819
ZINC000102864396
ZINC000102864399
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