Vitas-M small molecule compound
methyl 1-butyl-4-{[(2,4-dichlorophenyl)carbonyl]amino}-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK696089
SMILES CCCCN1C(=C(C(C1=O)(NC(=O)c1ccc(cc1Cl)Cl)C(F)(F)F)C(=O)OC)C
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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 C19H19Cl2F3N2O4 MW 467.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Cl2F3N2O4/c1-4-5-8-26-10(2)14(16(28)30-3)18(17(26)29,19(22,23)24)25-15(27)12-7-6-11(20)9-13(12)21/h6-7,9H,4-5,8H2,1-3H3,(H,25,27)InChIKey
FCRNOMAEDDZJNS-UHFFFAOYSA-NSynonyms
CCCCN1C(=C(C(C1=O)(C(F)(F)F)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)OC)C
InChI=1SC19H19Cl2F3N2O4c14582610(2)14(16(28)303)18(17(26)2919(2223)24)2515(27)127611(20)913(12)21h679H458H213H3(H2527)
methyl1butyl4(((24dichlorophenyl)carbonyl)amino)2methyl5oxo4(trifluoromethyl)45dihydro1Hpyrrole3carboxylate
methyl1butyl4((24dichlorobenzoyl)amino)2methyl5oxo4(trifluoromethyl)pyrrole3carboxylate
MFCD06177039
ZINC000012419968
ZINC000012419971
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