Vitas-M small molecule compound
(E)-(4-bromophenyl){1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Catalog ID
STK559140
SMILES C[NH+](CCCN1C(c2cccnc2)/C(=C(/c2ccc(cc2)Br)\[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 C21H22BrN3O3 MW 444.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O3/c1-24(2)11-4-12-25-18(15-5-3-10-23-13-15)17(20(27)21(25)28)19(26)14-6-8-16(22)9-7-14/h3,5-10,13,18,26H,4,11-12H2,1-2H3/b19-17+InChIKey
MPQQJTISSCWSDC-HTXNQAPBSA-NSynonyms
(4E)4((4BROMOPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5PYRIDIN3YLPYRROLIDINE23DIONE
(E)(4bromophenyl)(1(3(dimethylammonio)propyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)methanolate
(E)(4BROMOPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2PYRIDIN3YLPYRROLIDIN3YLIDENE)METHANOLATE
4((4BROMOPHENYL)CARBONYL)1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(PYRIDIN3YL)25DIHYDRO1HPYRROL2ONE
C(NH+)(C)CCCN1C(C(=C(C2=CC=C(C=C2)Br)(O))C(=O)C1=O)C3=CN=CC=C3
C(NH+)(CCCN1C(c2cccnc2)C(=C(c2ccc(cc2)Br)(O))C(=O)C1=O)C
InChI=1SC21H22BrN3O3c124(2)114122518(155310231315)17(20(27)21(25)28)19(26)146816(22)9714h3510131826H41112H212H3b1917+
MFCD18243198
ZINC000009177858
ZINC000009177862
Check stock
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Check stock on Vitas-MAvailable files
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