Vitas-M small molecule compound
methyl (5E)-1-(4-fluorophenyl)-2-methyl-4-oxo-5-[(5-{[(phenylsulfonyl)amino]methyl}furan-2-yl)methylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK169331
SMILES COC(=O)C1=C(C)N(/C(=C/c2ccc(o2)CNS(=O)(=O)c2ccccc2)/C1=O)c1ccc(cc1)F
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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 C25H21FN2O6S MW 496.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FN2O6S/c1-16-23(25(30)33-2)24(29)22(28(16)18-10-8-17(26)9-11-18)14-19-12-13-20(34-19)15-27-35(31,32)21-6-4-3-5-7-21/h3-14,27H,15H2,1-2H3/b22-14+InChIKey
JJTHJVLFDHGARD-HYARGMPZSA-NSynonyms
(E)methyl1(4fluorophenyl)2methyl4oxo5((5(phenylsulfonamidomethyl)furan2yl)methylene)45dihydro1Hpyrrole3carboxylate
CC1=C(C(=O)C(=CC2=CC=C(O2)CNS(=O)(=O)C3=CC=CC=C3)N1C4=CC=C(C=C4)F)C(=O)OC
COC(=O)C1=C(C)N(C(=Cc2ccc(o2)CNS(=O)(=O)c2ccccc2)C1=O)c1ccc(cc1)F
InChI=1SC25H21FN2O6Sc11623(25(30)332)24(29)22(28(16)1810817(26)91118)1419121320(3419)152735(3132)216435721h31427H15H212H3b2214+
METHYL(5E)1(4FLUOROPHENYL)2METHYL4OXO5((5(((PHENYLSULFONYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(5E)5((5(BENZENESULFONAMIDOMETHYL)FURAN2YL)METHYLIDENE)1(4FLUOROPHENYL)2METHYL4OXOPYRROLE3CARBOXYLATE
MFCD02233248
ZINC000009353391
ZINC09353391
ZINC9353391
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Check stock on Vitas-MAvailable files
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