4-bromanyl-N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]benzenesulfonamide Formula: C16H13BrClN3O2S MolecularWeight: 426.71532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)CN3C=C(C=N3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)CN3C=C(C=N3)Cl

InChI

InChI=1S/C16H13BrClN3O2S/c17-13-4-6-16(7-5-13)24(22,23)20-15-3-1-2-12(8-15)10-21-11-14(18)9-19-21/h1-9,11,20H,10H2