N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(trifluoromethoxy)benzenesulfonamide CAS Name: N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-3-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(trifluoromethoxy)benzenesulfonamide Formula: C18H16F3N3O3S MolecularWeight: 411.39815

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

InChI

InChI=1S/C18H16F3N3O3S/c1-23(12-14-11-22-24(13-14)15-6-3-2-4-7-15)28(25,26)17-9-5-8-16(10-17)27-18(19,20)21/h2-11,13H,12H2,1H3