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

Systemtic Name: 2-bromanyl-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide Openeye Name: 2-bromo-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide CAS Name: 2-bromo-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide IUPAC Name: 2-bromo-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide Traditional Name: 2-bromo-N-[5-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]benzenesulfonamide Formula: C18H18BrN3O5S MolecularWeight: 468.32162

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=CC=C3Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=NN2)NS(=O)(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C18H18BrN3O5S/c1-25-14-8-11(9-15(26-2)18(14)27-3)13-10-17(21-20-13)22-28(23,24)16-7-5-4-6-12(16)19/h4-10H,1-3H3,(H2,20,21,22)