Vitas-M small molecule compound

(E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate

Catalog ID
STK560364
SMILES O=C1C(=O)N(C(/C/1=C(/c1c(C)nc2n1cccc2)\[O-])c1ccncc1)CCCn1cc[nH+]c1

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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 C24H22N6O3 MW 442.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O3/c1-16-20(29-12-3-2-5-18(29)27-16)22(31)19-21(17-6-8-25-9-7-17)30(24(33)23(19)32)13-4-11-28-14-10-26-15-28/h2-3,5-10,12,14-15,21,31H,4,11,13H2,1H3/b22-19+
InChIKey
ADZDURRKDMPRIO-ZBJSNUHESA-N
Synonyms
846587-22-2
(4E)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)5PYRIDIN4YLPYRROLIDINE23DIONE
(E)(1(3(1Himidazol3ium1yl)propyl)45dioxo2(pyridin4yl)pyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
3HYDROXY1(3IMIDAZOLYLPROPYL)4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)5(4PYRIDYL)3PYRROLIN2ONE
846587222
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CCCN4C=CN=C4)C5=CC=NC=C5)O
InChI=1SC24H22N6O3c11620(291232518(29)2716)22(31)1921(1768259717)30(24(33)23(19)32)13411281410261528h235101214152131H41113H21H3b2219+
MFCD18243512
O=C1C(=O)N(C(C1=C(c1c(C)nc2n1cccc2)(O))c1ccncc1)CCCn1cc(nH+)c1
ZINC000102495391
ZINC000102495399

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Available files

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