propyl N-[4-[3-phenyl-5-(trifluoromethyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylcarbamate

Systemtic Name: propyl N-[4-[3-phenyl-5-(trifluoromethyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylcarbamate Openeye Name: propyl N-[4-[3-phenyl-5-(trifluoromethyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylcarbamate CAS Name: N-[4-[3-phenyl-5-(trifluoromethyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylcarbamic acid propyl ester IUPAC Name: propyl N-[4-[3-phenyl-5-(trifluoromethyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylcarbamate Traditional Name: N-[4-[5-phenyl-3-(trifluoromethyl)-2-pyrazolin-1-yl]phenyl]sulfonylcarbamic acid propyl ester Formula: C20H20F3N3O4S MolecularWeight: 455.45071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)NS(=O)(=O)C1=CC=C(C=C1)N2C(CC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)NS(=O)(=O)C1=CC=C(C=C1)N2C(CC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C20H20F3N3O4S/c1-2-12-30-19(27)25-31(28,29)16-10-8-15(9-11-16)26-17(14-6-4-3-5-7-14)13-18(24-26)20(21,22)23/h3-11,17H,2,12-13H2,1H3,(H,25,27)