Vitas-M small molecule compound
(E)-[2-(furan-2-yl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Catalog ID
STK566623
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)Cc1ccc[nH+]c1)/[O-]
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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 C24H22N2O5 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O5/c1-2-12-30-18-9-7-17(8-10-18)22(27)20-21(19-6-4-13-31-19)26(24(29)23(20)28)15-16-5-3-11-25-14-16/h3-11,13-14,21,27H,2,12,15H2,1H3/b22-20+InChIKey
YBKKFCWXAVTFAN-LSDHQDQOSA-NSynonyms
615270-42-3(4E)5(FURAN2YL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(FURAN2YL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
(E)(2(furan2yl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
5(2FURYL)3HYDROXY4((4PROPOXYPHENYL)CARBONYL)1(3PYRIDYLMETHYL)3PYRROLIN2ONE
615270423
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=CO4)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccco1)Cc1ccc(nH+)c1)(O)
InChI=1SC24H22N2O5c121230189717(81018)22(27)2021(1964133119)26(24(29)23(20)28)15165311251416h31113142127H21215H21H3b2220+
MFCD18245070
ZINC000102542894
ZINC000102542900
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.