Vitas-M small molecule compound
(E)-{2-(4-tert-butylphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Catalog ID
STL038137
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)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 C27H34N2O4 MW 450.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O4/c1-27(2,3)20-13-11-18(12-14-20)23-22(24(30)19-9-7-10-21(17-19)33-6)25(31)26(32)29(23)16-8-15-28(4)5/h7,9-14,17,23,30H,8,15-16H2,1-6H3/b24-22+InChIKey
AVNXAABACLXLBM-ZNTNEXAZSA-NSynonyms
608498-04-0(4E)5(4TERTBUTYLPHENYL)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4tertbutylphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(2(4TERTBUTYLPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)5(4(TERTBUTYL)PHENYL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
608498040
CC(C)(C)C1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2CCCN(C)C
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)CCC(NH+)(C)C)(O)
InChI=1SC27H34N2O4c127(23)20131118(121420)2322(24(30)19971021(1719)336)25(31)26(32)29(23)1681528(4)5h7914172330H81516H216H3b2422+
MFCD18247565
ZINC000008900686
ZINC000102860088
Check stock
See real-time availability and sample size for STL038137 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.