Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Catalog ID
STK559335
SMILES C[NH+](CCN1C(c2cccs2)/C(=C(/c2c(C)nc3n2cccc3)\[O-])/C(=O)C1=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 C21H22N4O3S MW 410.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S/c1-13-17(24-9-5-4-8-15(24)22-13)19(26)16-18(14-7-6-12-29-14)25(11-10-23(2)3)21(28)20(16)27/h4-9,12,18,26H,10-11H2,1-3H3/b19-16+InChIKey
VRJHGACGPYORIT-KNTRCKAVSA-NSynonyms
848207-48-7(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)5THIOPHEN2YLPYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
848207487
C(NH+)(CCN1C(c2cccs2)C(=C(c2c(C)nc3n2cccc3)(O))C(=O)C1=O)C
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CC(NH+)(C)C)C4=CC=CS4)(O)
InChI=1SC21H22N4O3Sc11317(24954815(24)2213)19(26)1618(1476122914)25(111023(2)3)21(28)20(16)27h49121826H1011H213H3b1916+
MFCD18243237
ZINC000102486179
ZINC000102486185
Check stock
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Check stock on Vitas-MAvailable files
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