4-bromanyl-N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxy-phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[5-[(3S,5R)-3,5-dimethyl-1-piperazinyl]-2-methoxyphenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[5-[(3S,5R)-3,5-dimethylpiperazino]-2-methoxy-phenyl]benzenesulfonamide Formula: C19H24BrN3O3S MolecularWeight: 454.38116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=CC(=C(C=C2)OC)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H24BrN3O3S/c1-13-11-23(12-14(2)21-13)16-6-9-19(26-3)18(10-16)22-27(24,25)17-7-4-15(20)5-8-17/h4-10,13-14,21-22H,11-12H2,1-3H3/t13-,14+