Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(tetrahydrofuran-2-ylmethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL045736
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CC1CCCO1)/O
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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 C21H21NO5S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5S/c1-26-14-8-6-13(7-9-14)19(23)17-18(16-5-3-11-28-16)22(21(25)20(17)24)12-15-4-2-10-27-15/h3,5-9,11,15,18,23H,2,4,10,12H2,1H3/b19-17+InChIKey
AUMSWUMVHQBOFD-HTXNQAPBSA-NSynonyms
489396-68-1(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(OXOLAN2YLMETHYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(4E)4(hydroxy(4methoxyphenyl)methylidene)1(tetrahydrofuran2ylmethyl)5(thiophen2yl)pyrrolidine23dione
489396681
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3CCCO3)C4=CC=CS4)O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccs1)CC1CCCO1)O
InChI=1SC21H21NO5Sc126148613(7914)19(23)1718(1653112816)22(21(25)20(17)24)121542102715h35911151823H241012H21H3b1917+
MFCD03798383
ZINC000102878649
ZINC000102878659
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