ethyl 7-(4-bromanyl-2-methyl-pyrazol-3-yl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 7-(4-bromanyl-2-methyl-pyrazol-3-yl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 7-(4-bromo-2-methyl-pyrazol-3-yl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzofuran-2-carboxylate CAS Name: 7-(4-bromo-2-methyl-3-pyrazolyl)-5-[[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-bromo-2-methylpyrazol-3-yl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]-1-benzofuran-2-carboxylate Traditional Name: 7-(4-bromo-2-methyl-pyrazol-3-yl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]coumarilic acid ethyl ester Formula: C23H18BrF3N4O4 MolecularWeight: 551.31263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC(=CC(=C2O1)C3=C(C=NN3C)Br)NC(=O)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC2=CC(=CC(=C2O1)C3=C(C=NN3C)Br)NC(=O)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H18BrF3N4O4/c1-3-34-21(32)18-9-12-8-15(10-16(20(12)35-18)19-17(24)11-28-31(19)2)30-22(33)29-14-6-4-13(5-7-14)23(25,26)27/h4-11H,3H2,1-2H3,(H2,29,30,33)