ethyl 3-propan-2-yl-1-propyl-5-[[4-[2-(trifluoromethylsulfonylamino)phenyl]phenyl]methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 3-propan-2-yl-1-propyl-5-[[4-[2-(trifluoromethylsulfonylamino)phenyl]phenyl]methyl]pyrazole-4-carboxylate Openeye Name: ethyl 3-isopropyl-1-propyl-5-[[4-[2-(trifluoromethylsulfonylamino)phenyl]phenyl]methyl]pyrazole-4-carboxylate CAS Name: 3-propan-2-yl-1-propyl-5-[[4-[2-(trifluoromethylsulfonylamino)phenyl]phenyl]methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-propan-2-yl-1-propyl-5-[[4-[2-(trifluoromethylsulfonylamino)phenyl]phenyl]methyl]pyrazole-4-carboxylate Traditional Name: 3-isopropyl-1-propyl-5-[4-[2-(triflylamino)phenyl]benzyl]pyrazole-4-carboxylic acid ethyl ester Formula: C26H30F3N3O4S MolecularWeight: 537.59431

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C(C)C)C(=O)OCC)CC2=CC=C(C=C2)C3=CC=CC=C3NS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCN1C(=C(C(=N1)C(C)C)C(=O)OCC)CC2=CC=C(C=C2)C3=CC=CC=C3NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C26H30F3N3O4S/c1-5-15-32-22(23(25(33)36-6-2)24(30-32)17(3)4)16-18-11-13-19(14-12-18)20-9-7-8-10-21(20)31-37(34,35)26(27,28)29/h7-14,17,31H,5-6,15-16H2,1-4H3