Vitas-M small molecule compound
methyl 4-[(3E)-3-[hydroxy(thiophen-2-yl)methylidene]-4,5-dioxo-1-(tetrahydrofuran-2-ylmethyl)pyrrolidin-2-yl]benzoate
Catalog ID
STK561174
SMILES COC(=O)c1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1CC1CCCO1
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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 C22H21NO6S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6S/c1-28-22(27)14-8-6-13(7-9-14)18-17(19(24)16-5-3-11-30-16)20(25)21(26)23(18)12-15-4-2-10-29-15/h3,5-9,11,15,18,24H,2,4,10,12H2,1H3/b19-17+InChIKey
AOBVSKMORSBCRR-HTXNQAPBSA-NSynonyms
COC(=O)c1ccc(cc1)C1C(=C(c2cccs2)O)C(=O)C(=O)N1CC1CCCO1
methyl4((3E)3(hydroxy(thiophen2yl)methylidene)45dioxo1(tetrahydrofuran2ylmethyl)pyrrolidin2yl)benzoate
MFCD03804083
ZINC000102501985
ZINC000102644123
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