Vitas-M small molecule compound
(E)-{2-(3-bromophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-butoxy-3-methylphenyl)methanolate
Catalog ID
STL150582
SMILES CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)CCC[NH+](C)C)/[O-]
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C27H33BrN2O4 MW 529.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33BrN2O4/c1-5-6-15-34-22-12-11-20(16-18(22)2)25(31)23-24(19-9-7-10-21(28)17-19)30(27(33)26(23)32)14-8-13-29(3)4/h7,9-12,16-17,24,31H,5-6,8,13-15H2,1-4H3/b25-23+InChIKey
RMOKQKJGBQYNBJ-WJTDDFOZSA-NSynonyms
500106-45-6(4E)5(3BROMOPHENYL)4((4BUTOXY3METHYLPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)PYRROLIDINE23DIONE
(E)(2(3bromophenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(4butoxy3methylphenyl)methanolate
(E)(2(3BROMOPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4BUTOXY3METHYLPHENYL)METHANOLATE
500106456
CCCCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)(C)C)C3=CC(=CC=C3)Br)(O))C
CCCCOc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Br)CCC(NH+)(C)C)(O)
InChI=1SC27H33BrN2O4c156153422121120(1618(22)2)25(31)2324(19971021(28)1719)30(27(33)26(23)32)1481329(3)4h791216172431H5681315H214H3b2523+
MFCD20755866
ZINC000102931867
ZINC000102931869
Check stock
See real-time availability and sample size for STL150582 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.