ethanamine; 4-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: ethanamine; 4-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: ethanamine; 4-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: ethanamine; 4-[5-phenyl-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: ethanamine; 4-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: ethylamine; 4-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C18H19F3N4O2S MolecularWeight: 412.42927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN.C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

CCN.C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S.C2H7N/c17-16(18,19)15-10-14(11-4-2-1-3-5-11)22(21-15)12-6-8-13(9-7-12)25(20,23)24;1-2-3/h1-10H,(H2,20,23,24);2-3H2,1H3