Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(2,5-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STK564268
SMILES COc1ccc(cc1C1N(CCC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1cccs1)/[O-])OC
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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)12-8-13-26-21(17-15-16(30-3)10-11-18(17)31-4)20(23(28)24(26)29)22(27)19-9-7-14-32-19/h7,9-11,14-15,21,27H,5-6,8,12-13H2,1-4H3/b22-20+InChIKey
IUNQMEJYLWPEHU-LSDHQDQOSA-NSynonyms
(E)(1(3(diethylammonio)propyl)2(25dimethoxyphenyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
COc1ccc(cc1C1N(CCC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1cccs1)(O))OC
MFCD18244497
ZINC000009270246
ZINC000009270248
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