Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STL045357
SMILES CCOc1ccc(cc1OC)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CC[NH+](CC)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 C24H30N2O5S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O5S/c1-5-25(6-2)12-13-26-21(16-10-11-17(31-7-3)18(15-16)30-4)20(23(28)24(26)29)22(27)19-9-8-14-32-19/h8-11,14-15,21,27H,5-7,12-13H2,1-4H3/b22-20+InChIKey
MILAUIAZPCBJKC-LSDHQDQOSA-NSynonyms
(E)(1(2(diethylammonio)ethyl)2(4ethoxy3methoxyphenyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
CCOc1ccc(cc1OC)C1C(=C(c2cccs2)(O))C(=O)C(=O)N1CC(NH+)(CC)CC
MFCD18248624
ZINC000009008018
ZINC000009008019
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