Vitas-M small molecule compound
(E)-(3,4-dimethoxyphenyl){1-[3-(dimethylammonio)propyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK564447
SMILES COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CCC[NH+](C)C)/[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 C24H27FN2O5 MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27FN2O5/c1-26(2)12-7-13-27-21(16-8-5-6-9-17(16)25)20(23(29)24(27)30)22(28)15-10-11-18(31-3)19(14-15)32-4/h5-6,8-11,14,21,28H,7,12-13H2,1-4H3/b22-20+InChIKey
HTIBZABCJXZQMF-LSDHQDQOSA-NSynonyms
615271-52-8(4E)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(2FLUOROPHENYL)PYRROLIDINE23DIONE
(E)(34dimethoxyphenyl)(1(3(dimethylammonio)propyl)2(2fluorophenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(34DIMETHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(2FLUOROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4((34DIMETHOXYPHENYL)CARBONYL)1(3(DIMETHYLAMINO)PROPYL)5(2FLUOROPHENYL)3HYDROXY3PYRROLIN2ONE
615271528
C(NH+)(C)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)OC)(O))C(=O)C1=O)C3=CC=CC=C3F
COc1ccc(cc1OC)C(=C1C(=O)C(=O)N(C1c1ccccc1F)CCC(NH+)(C)C)(O)
InChI=1SC24H27FN2O5c126(2)127132721(16856917(16)25)20(23(29)24(27)30)22(28)15101118(313)19(1415)324h56811142128H71213H214H3b2220+
MFCD18244540
ZINC000009046344
ZINC000009173230
Check stock
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Check stock on Vitas-MAvailable files
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