6-(3-bromanylphenoxy)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-bromanylphenoxy)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 6-(3-bromophenoxy)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 6-(3-bromophenoxy)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-bromophenoxy)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 6-(3-bromophenoxy)-N-[4-(3-ketopiperazino)benzyl]nicotinamide Formula: C23H21BrN4O3 MolecularWeight: 481.34184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=CN=C(C=C3)OC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=CN=C(C=C3)OC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H21BrN4O3/c24-18-2-1-3-20(12-18)31-22-9-6-17(14-26-22)23(30)27-13-16-4-7-19(8-5-16)28-11-10-25-21(29)15-28/h1-9,12,14H,10-11,13,15H2,(H,25,29)(H,27,30)