N-(2-bromanyl-5-methyl-phenyl)-3-(4-ethanoylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(2-bromanyl-5-methyl-phenyl)-3-(4-ethanoylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: 3-(4-acetylpiperazine-1-carbonyl)-N-(2-bromo-5-methyl-phenyl)benzenesulfonamide CAS Name: 3-[(4-acetyl-1-piperazinyl)-oxomethyl]-N-(2-bromo-5-methylphenyl)benzenesulfonamide IUPAC Name: 3-(4-acetylpiperazine-1-carbonyl)-N-(2-bromo-5-methylphenyl)benzenesulfonamide Traditional Name: 3-(4-acetylpiperazine-1-carbonyl)-N-(2-bromo-5-methyl-phenyl)benzenesulfonamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C20H22BrN3O4S/c1-14-6-7-18(21)19(12-14)22-29(27,28)17-5-3-4-16(13-17)20(26)24-10-8-23(9-11-24)15(2)25/h3-7,12-13,22H,8-11H2,1-2H3