5-[4-(methylamino)phenyl]-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-[4-(methylamino)phenyl]-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-[4-(methylamino)phenyl]-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-[4-(methylamino)phenyl]-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-[4-(methylamino)phenyl]-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-[4-(methylamino)phenyl]-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole Formula: C17H15F3N4O2S MolecularWeight: 396.38681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OS(=O)N)C(F)(F)F

Isomeric SMILES

CNC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OS(=O)N)C(F)(F)F

InChI

InChI=1S/C17H15F3N4O2S/c1-22-12-4-2-11(3-5-12)15-10-16(17(18,19)20)23-24(15)13-6-8-14(9-7-13)26-27(21)25/h2-10,22H,21H2,1H3