Vitas-M small molecule compound

(E)-[4,5-dioxo-2-(4-propoxyphenyl)-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](phenyl)methanolate

Catalog ID
STK563538
SMILES CCCOc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1Cc1ccc[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 C26H24N2O4 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O4/c1-2-15-32-21-12-10-19(11-13-21)23-22(24(29)20-8-4-3-5-9-20)25(30)26(31)28(23)17-18-7-6-14-27-16-18/h3-14,16,23,29H,2,15,17H2,1H3/b24-22+
InChIKey
VISVALOAAQFJOF-ZNTNEXAZSA-N
Synonyms
615271-34-6
(4E)4(HYDROXY(PHENYL)METHYLIDENE)5(4PROPOXYPHENYL)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(45DIOXO2(4PROPOXYPHENYL)1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
(E)(45dioxo2(4propoxyphenyl)1(pyridinium3ylmethyl)pyrrolidin3ylidene)(phenyl)methanolate
615271346
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)(O))C(=O)C(=O)N2CC4=C(NH+)=CC=C4
CCCOc1ccc(cc1)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1Cc1ccc(nH+)c1
InChI=1SC26H24N2O4c12153221121019(111321)2322(24(29)208435920)25(30)26(31)28(23)17187614271618h314162329H21517H21H3b2422+
MFCD18244326
ZINC000102521328
ZINC000102521336

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Available files

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