Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanolate
Catalog ID
STL039696
SMILES COc1cccc(c1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2C)/[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 C25H28N4O4 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4/c1-15-8-7-11-28-20(16(2)26-24(15)28)22(30)19-21(17-9-6-10-18(14-17)33-5)29(13-12-27(3)4)25(32)23(19)31/h6-11,14,21,30H,12-13H2,1-5H3/b22-19+InChIKey
BITKXFVPFFYMNJ-ZBJSNUHESA-NSynonyms
845903-79-9(4E)1(2DIMETHYLAMINOETHYL)4((28DIMETHYLIMIDAZO(12A)PYRIDIN3YL)HYDROXYMETHYLIDENE)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)(28dimethylimidazo(12a)pyridin3yl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(28DIMETHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
845903799
CC1=CC=CN2C1=NC(=C2C(=C3C(N(C(=O)C3=O)CC(NH+)(C)C)C4=CC(=CC=C4)OC)(O))C
COc1cccc(c1)C1N(CC(NH+)(C)C)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2C)(O)
InChI=1SC25H28N4O4c11587112820(16(2)2624(15)28)22(30)1921(17961018(1417)335)29(131227(3)4)25(32)23(19)31h611142130H1213H215H3b2219+
MFCD18247881
ZINC000102864476
ZINC000102864477
Check stock
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Check stock on Vitas-MAvailable files
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