Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL150439
SMILES CC(Oc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C)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 C25H30N2O4 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4/c1-17(2)31-20-13-11-18(12-14-20)22-21(23(28)19-9-6-5-7-10-19)24(29)25(30)27(22)16-8-15-26(3)4/h5-7,9-14,17,22,28H,8,15-16H2,1-4H3/b23-21+InChIKey
FZJMWWRESAYDCF-XTQSDGFTSA-NSynonyms
613219-90-2(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(PHENYL)METHYLIDENE)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(4(propan2yloxy)phenyl)pyrrolidin3ylidene)(phenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(4PROPAN2YLOXYPHENYL)PYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(4(METHYLETHOXY)PHENYL)4(PHENYLCARBONYL)3PYRROLIN2ONE
613219902
CC(C)OC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2CCCN(C)C
CC(Oc1ccc(cc1)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1CCC(NH+)(C)C)C
InChI=1SC25H30N2O4c117(2)3120131118(121420)2221(23(28)1996571019)24(29)25(30)27(22)1681526(3)4h57914172228H81516H214H3b2321+
MFCD20755831
ZINC000102374282
ZINC000102374286
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.