Vitas-M small molecule compound
(E)-{2-(3-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(pyridin-4-yl)methanolate
Catalog ID
STK566606
SMILES COc1cccc(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccncc1)/[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 C24H27N3O5 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O5/c1-31-19-5-2-4-18(16-19)21-20(22(28)17-6-8-25-9-7-17)23(29)24(30)27(21)11-3-10-26-12-14-32-15-13-26/h2,4-9,16,21,28H,3,10-15H2,1H3/b22-20+InChIKey
BMZAYSUMBLYOAK-LSDHQDQOSA-NSynonyms
627487-27-8(4E)4(HYDROXY(PYRIDIN4YL)METHYLIDENE)5(3METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(3methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(pyridin4yl)methanolate
(E)(2(3METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)PYRIDIN4YLMETHANOLATE
3HYDROXY5(3METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)4(4PYRIDYLCARBONYL)3PYRROLIN2ONE
627487278
COC1=CC=CC(=C1)C2C(=C(C3=CC=NC=C3)(O))C(=O)C(=O)N2CCC(NH+)4CCOCC4
COc1cccc(c1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccncc1)(O)
InChI=1SC24H27N3O5c1311952418(1619)2120(22(28)1768259717)23(29)24(30)27(21)1131026121432151326h249162128H31015H21H3b2220+
MFCD18245067
ZINC000008901302
ZINC000008901307
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.