Vitas-M small molecule compound
methyl (5E)-2-methyl-4-oxo-5-[2-(trifluoromethyl)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160014
SMILES COC(=O)C1=C(C)N/C(=C/c2ccccc2C(F)(F)F)/C1=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 C15H12F3NO3 MW 311.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12F3NO3/c1-8-12(14(21)22-2)13(20)11(19-8)7-9-5-3-4-6-10(9)15(16,17)18/h3-7,19H,1-2H3/b11-7+InChIKey
QPKHLXTZRCFWBJ-YRNVUSSQSA-NSynonyms
CC1=C(C(=O)C(=CC2=CC=CC=C2C(F)(F)F)N1)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2ccccc2C(F)(F)F)C1=O
InChI=1SC15H12F3NO3c1812(14(21)222)13(20)11(198)79534610(9)15(1617)18h3719H12H3b117+
METHYL(5E)2METHYL4OXO5((2(TRIFLUOROMETHYL)PHENYL)METHYLIDENE)1HPYRROLE3CARBOXYLATE
METHYL(5E)2METHYL4OXO5(2(TRIFLUOROMETHYL)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01987816
ZINC000004095438
ZINC04095438
ZINC4095438
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Check stock on Vitas-MAvailable files
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