N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-tert-butyl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]-4-tert-butyl-benzenesulfonamide Formula: C20H20BrCl2N3O2S MolecularWeight: 517.2667

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H20BrCl2N3O2S/c1-20(2,3)14-5-7-15(8-6-14)29(27,28)25-19-16(21)12-26(24-19)11-13-4-9-17(22)18(23)10-13/h4-10,12H,11H2,1-3H3,(H,24,25)