Vitas-M small molecule compound
(E)-{2-(4-ethylphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STL149838
SMILES CCc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1
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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 C26H30N2O4 MW 434.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O4/c1-3-19-6-10-20(11-7-19)23-22(24(29)21-8-4-18(2)5-9-21)25(30)26(31)28(23)13-12-27-14-16-32-17-15-27/h4-11,23,29H,3,12-17H2,1-2H3/b24-22+InChIKey
MNCYELKXKVYGLX-ZNTNEXAZSA-NSynonyms
489405-65-4(4E)5(4ETHYLPHENYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(4ethylphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(2(4ETHYLPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
489405654
CCC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)C)(O))C(=O)C(=O)N2CC(NH+)4CCOCC4
CCc1ccc(cc1)C1C(=C(c2ccc(cc2)C)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
InChI=1SC26H30N2O4c131961020(11719)2322(24(29)218418(2)5921)25(30)26(31)28(23)131227141632171527h4112329H31217H212H3b2422+
MFCD20755683
ZINC000009334436
ZINC000009353669
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