Vitas-M small molecule compound
(E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(2-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Catalog ID
STL150490
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)CCCn1cc[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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c1-32-18-8-5-7-17(15-18)23(29)21-22(19-9-3-4-10-20(19)33-2)28(25(31)24(21)30)13-6-12-27-14-11-26-16-27/h3-5,7-11,14-16,22,29H,6,12-13H2,1-2H3/b23-21+InChIKey
AVAXDWPGVVODGJ-XTQSDGFTSA-NSynonyms
615276-79-4(4E)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)5(2METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(1Himidazol3ium1yl)propyl)2(2methoxyphenyl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
3HYDROXY1(3(1HIMIDAZOL1YL)PROPYL)4(3METHOXYBENZOYL)5(2METHOXYPHENYL)15DIHYDRO2HPYRROL2ONE
3HYDROXY1(3IMIDAZOLYLPROPYL)5(2METHOXYPHENYL)4((3METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615276794
COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CC=C4OC)O
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1ccccc1OC)CCCn1cc(nH+)c1)(O)
InChI=1SC25H25N3O5c1321885717(1518)23(29)2122(199341020(19)332)28(25(31)24(21)30)13612271411261627h3571114162229H61213H212H3b2321+
MFCD20755841
ZINC000102932038
ZINC000102932042
Check stock
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Check stock on Vitas-MAvailable files
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