Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanolate
Catalog ID
STK558910
SMILES C[NH+](CCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3C)/[O-])/C1c1ccc(cc1)[N+](=O)[O-])C
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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 C24H25N5O5 MW 463.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O5/c1-14-6-5-11-27-19(15(2)25-23(14)27)21(30)18-20(16-7-9-17(10-8-16)29(33)34)28(13-12-26(3)4)24(32)22(18)31/h5-11,20,30H,12-13H2,1-4H3/b21-18+InChIKey
JWIAIMNOLBKQRX-DYTRJAOYSA-NSynonyms
845804-81-1(4E)1(2DIMETHYLAMINOETHYL)4((28DIMETHYLIMIDAZO(12A)PYRIDIN3YL)HYDROXYMETHYLIDENE)5(4NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(4nitrophenyl)45dioxopyrrolidin3ylidene)(28dimethylimidazo(12a)pyridin3yl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(28DIMETHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
845804811
C(NH+)(CCN1C(=O)C(=O)C(=C(c2c(C)nc3n2cccc3C)(O))C1c1ccc(cc1)(N+)(=O)(O))C
CC1=CC=CN2C1=NC(=C2C(=C3C(N(C(=O)C3=O)CC(NH+)(C)C)C4=CC=C(C=C4)(N+)(=O)(O))(O))C
InChI=1SC24H25N5O5c11465112719(15(2)2523(14)27)21(30)1820(167917(10816)29(33)34)28(131226(3)4)24(32)22(18)31h5112030H1213H214H3b2118+
MFCD18243140
ZINC000102483155
ZINC000102483164
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.