Vitas-M small molecule compound
(E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STL040174
SMILES CCCOc1cccc(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1
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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 C24H28N2O5S MW 456.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O5S/c1-2-12-31-18-6-3-5-17(16-18)21-20(22(27)19-7-4-15-32-19)23(28)24(29)26(21)9-8-25-10-13-30-14-11-25/h3-7,15-16,21,27H,2,8-14H2,1H3/b22-20+InChIKey
GFQSZHFBBVGPBP-LSDHQDQOSA-NSynonyms
(E)(1(2(morpholin4ium4yl)ethyl)45dioxo2(3propoxyphenyl)pyrrolidin3ylidene)(thiophen2yl)methanolate
CCCOc1cccc(c1)C1C(=C(c2cccs2)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
MFCD18247971
ZINC000009233803
ZINC000009233808
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