4-bromanyl-N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-[4-(4-cyanobenzyl)piperazino]-3-keto-propyl]benzenesulfonamide Formula: C21H23BrN4O3S MolecularWeight: 491.40132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN4O3S/c22-19-5-7-20(8-6-19)30(28,29)24-10-9-21(27)26-13-11-25(12-14-26)16-18-3-1-17(15-23)2-4-18/h1-8,24H,9-14,16H2