4-fluoranyl-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide CAS Name: 4-fluoro-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide Formula: C18H18FN3O5S MolecularWeight: 407.416023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=NN2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=NN2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3O5S/c1-25-15-8-11(9-16(26-2)18(15)27-3)14-10-17(21-20-14)22-28(23,24)13-6-4-12(19)5-7-13/h4-10H,1-3H3,(H2,20,21,22)