Vitas-M small molecule compound
ethyl (4Z)-4-({2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK011660
SMILES COCCN1C(=O)/C(=C\c2cc(n(c2C)c2ccccc2C(F)(F)F)C)/C(=C1C)C(=O)OCC
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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 C25H27F3N2O4 MW 476.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27F3N2O4/c1-6-34-24(32)22-17(4)29(11-12-33-5)23(31)19(22)14-18-13-15(2)30(16(18)3)21-10-8-7-9-20(21)25(26,27)28/h7-10,13-14H,6,11-12H2,1-5H3/b19-14-InChIKey
OOXVBQYGTNUZTB-RGEXLXHISA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=C(N(C(=C2)C)C3=CC=CC=C3C(F)(F)F)C)CCOC)C
COCCN1C(=O)C(=Cc2cc(n(c2C)c2ccccc2C(F)(F)F)C)C(=C1C)C(=O)OCC
ETHYL(4Z)4((25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)1HPYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)PYRROL3YL)METHYLIDENE)1(2METHOXYETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
ETHYL4((25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)1HPYRROL3YL)METHYLENE)1(2METHOXYETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC25H27F3N2O4c163424(32)2217(4)29(1112335)23(31)19(22)14181315(2)30(16(18)3)211087920(21)25(2627)28h7101314H61112H215H3b1914
MFCD03269946
STK011660
ZINC000013939885
ZINC13939885
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.