N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-butan-2-yl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-butan-2-yl-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-sec-butyl-benzenesulfonamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-4-butan-2-ylbenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-butan-2-ylbenzenesulfonamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-4-sec-butyl-benzenesulfonamide Formula: C20H21BrClN3O2S MolecularWeight: 482.82164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21BrClN3O2S/c1-3-14(2)15-8-10-17(11-9-15)28(26,27)24-20-18(21)13-25(23-20)12-16-6-4-5-7-19(16)22/h4-11,13-14H,3,12H2,1-2H3,(H,23,24)