methyl 2-[[4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoyl]amino]benzoate CAS Name: 2-[[oxo-[4-[5-thiophen-2-yl-3-(trifluoromethyl)-1-pyrazolyl]phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzoyl]amino]benzoate Traditional Name: 2-[[4-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoyl]amino]benzoic acid methyl ester Formula: C23H16F3N3O3S MolecularWeight: 471.45165

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C23H16F3N3O3S/c1-32-22(31)16-5-2-3-6-17(16)27-21(30)14-8-10-15(11-9-14)29-18(19-7-4-12-33-19)13-20(28-29)23(24,25)26/h2-13H,1H3,(H,27,30)