Vitas-M small molecule compound
(E)-(4-methylphenyl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STL037515
SMILES C=CCOc1cccc(c1)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 C27H30N2O5 MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5/c1-3-15-34-22-6-4-5-21(18-22)24-23(25(30)20-9-7-19(2)8-10-20)26(31)27(32)29(24)12-11-28-13-16-33-17-14-28/h3-10,18,24,30H,1,11-17H2,2H3/b25-23+InChIKey
GSDYANBEONPSML-WJTDDFOZSA-NSynonyms
619275-70-6(4E)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(4methylphenyl)(1(2(morpholin4ium4yl)ethyl)45dioxo2(3(prop2en1yloxy)phenyl)pyrrolidin3ylidene)methanolate
(E)(4METHYLPHENYL)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(3PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY4((4METHYLPHENYL)CARBONYL)1(2MORPHOLIN4YLETHYL)5(3PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
619275706
C=CCOc1cccc(c1)C1C(=C(c2ccc(cc2)C)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC(=CC=C4)OCC=C)O
InChI=1SC27H30N2O5c1315342264521(1822)2423(25(30)209719(2)81020)26(31)27(32)29(24)121128131633171428h310182430H11117H22H3b2523+
MFCD18247445
ZINC000101313332
ZINC000101313334
Check stock
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Check stock on Vitas-MAvailable files
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