Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(2,5-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[3-fluoro-4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STK593587
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)F)OC(C)C)/[O-])/C1c1cc(OC)ccc1OC)CC
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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 C29H37FN2O6 MW 528.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37FN2O6/c1-7-31(8-2)14-9-15-32-26(21-17-20(36-5)11-13-23(21)37-6)25(28(34)29(32)35)27(33)19-10-12-24(22(30)16-19)38-18(3)4/h10-13,16-18,26,33H,7-9,14-15H2,1-6H3/b27-25+InChIKey
PTCLPRYMAZKNOX-IMVLJIQESA-NSynonyms
902325-06-8(4E)1(3(DIETHYLAMINO)PROPYL)5(25DIMETHOXYPHENYL)4((3FLUORO4PROPAN2YLOXYPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)2(25dimethoxyphenyl)45dioxopyrrolidin3ylidene)(3fluoro4(propan2yloxy)phenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(25DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(3FLUORO4PROPAN2YLOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)5(25DIMETHOXYPHENYL)4((3FLUORO4(METHYLETHOXY)PHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
902325068
CC(NH+)(CC)CCCN1C(C(=C(C2=CC(=C(C=C2)OC(C)C)F)(O))C(=O)C1=O)C3=C(C=CC(=C3)OC)OC
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2ccc(c(c2)F)OC(C)C)(O))C1c1cc(OC)ccc1OC)CC
InChI=1SC29H37FN2O6c1731(82)149153226(211720(365)111323(21)376)25(28(34)29(32)35)27(33)19101224(22(30)1619)3818(3)4h101316182633H791415H216H3b2725+
MFCD18245966
ZINC000102612784
ZINC000102612788
Check stock
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Check stock on Vitas-MAvailable files
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