Vitas-M small molecule compound
methyl 2-[(3E)-3-[(4-fluorophenyl)(hydroxy)methylidene]-2-(furan-2-yl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL044096
SMILES COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1ccco1
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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 C21H15FN2O6S MW 442.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN2O6S/c1-10-18(20(28)29-2)31-21(23-10)24-15(13-4-3-9-30-13)14(17(26)19(24)27)16(25)11-5-7-12(22)8-6-11/h3-9,15,25H,1-2H3/b16-14+InChIKey
JSLREFXXMRKAOK-JQIJEIRASA-NSynonyms
384365-64-4384365644
CC1=C(SC(=N1)N2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=CO4)C(=O)OC
COC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2)F)O)C1c1ccco1
InChI=1SC21H15FN2O6Sc11018(20(28)292)3121(2310)2415(134393013)14(17(26)19(24)27)16(25)115712(22)8611h391525H12H3b1614+
methyl2((3E)3((4fluorophenyl)(hydroxy)methylidene)2(furan2yl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((3E)3((4FLUOROPHENYL)HYDROXYMETHYLIDENE)2(FURAN2YL)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(3(4FLUOROBENZOYL)2(2FURYL)4HYDROXY5OXO25DIHYDRO1HPYRROL1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(4((4FLUOROPHENYL)CARBONYL)5(2FURYL)3HYDROXY2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03817360
ZINC000102874066
ZINC000102874070
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.