Vitas-M small molecule compound
(E)-[2-(2,5-dimethoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](thiophen-2-yl)methanolate
Catalog ID
STL038854
SMILES COc1ccc(c(c1)C1/C(=C(/c2cccs2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1)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 C23H20N2O5S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O5S/c1-29-15-7-8-17(30-2)16(11-15)20-19(21(26)18-6-4-10-31-18)22(27)23(28)25(20)13-14-5-3-9-24-12-14/h3-12,20,26H,13H2,1-2H3/b21-19+InChIKey
SPCPWPDJRKLNJP-XUTLUUPISA-NSynonyms
(E)(2(25dimethoxyphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(thiophen2yl)methanolate
COc1ccc(c(c1)C1C(=C(c2cccs2)(O))C(=O)C(=O)N1Cc1ccc(nH+)c1)OC
MFCD18247714
ZINC000102863037
ZINC000102863040
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