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

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoate CAS Name: 4-[5-thiophen-2-yl-3-(trifluoromethyl)-1-pyrazolyl]benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzoate Traditional Name: 4-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C28H16F3N3O2S MolecularWeight: 515.50575

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NN2C3=CC=C(C=C3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N)C(F)(F)F

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NN2C3=CC=C(C=C3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N)C(F)(F)F

InChI

InChI=1S/C28H16F3N3O2S/c29-28(30,31)26-16-24(25-2-1-15-37-25)34(33-26)22-11-7-21(8-12-22)27(35)36-23-13-9-20(10-14-23)19-5-3-18(17-32)4-6-19/h1-16H