methyl 2-[[3-bromanyl-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[3-bromanyl-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]benzoate CAS Name: 2-[[[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]benzoate Traditional Name: 2-[[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]benzoic acid methyl ester Formula: C22H13Br2F3N4O3 MolecularWeight: 598.16683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=NN3C(=CC(=NC3=C2Br)C4=CC=C(C=C4)Br)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=NN3C(=CC(=NC3=C2Br)C4=CC=C(C=C4)Br)C(F)(F)F

InChI

InChI=1S/C22H13Br2F3N4O3/c1-34-21(33)13-4-2-3-5-14(13)29-20(32)18-17(24)19-28-15(11-6-8-12(23)9-7-11)10-16(22(25,26)27)31(19)30-18/h2-10H,1H3,(H,29,32)