Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STK564929
SMILES CCCOc1cccc(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CC[NH+](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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c1-4-12-28-16-8-5-7-15(14-16)19-18(20(25)17-9-6-13-29-17)21(26)22(27)24(19)11-10-23(2)3/h5-9,13-14,19,25H,4,10-12H2,1-3H3/b20-18+InChIKey
DZCBEYDODVXOKW-CZIZESTLSA-NSynonyms
(E)(1(2(dimethylammonio)ethyl)45dioxo2(3propoxyphenyl)pyrrolidin3ylidene)(thiophen2yl)methanolate
CCCOc1cccc(c1)C1C(=C(c2cccs2)(O))C(=O)C(=O)N1CC(NH+)(C)C
MFCD18244650
ZINC000006783490
ZINC000006783497
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