2-(3-bromanylphenoxy)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-(3-bromanylphenoxy)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]pyridine-3-carboxamide Openeye Name: 2-(3-bromophenoxy)-N-[4-(3-oxopiperazin-1-yl)phenyl]pyridine-3-carboxamide CAS Name: 2-(3-bromophenoxy)-N-[4-(3-oxo-1-piperazinyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-(3-bromophenoxy)-N-[4-(3-oxopiperazin-1-yl)phenyl]pyridine-3-carboxamide Traditional Name: 2-(3-bromophenoxy)-N-[4-(3-ketopiperazino)phenyl]nicotinamide Formula: C22H19BrN4O3 MolecularWeight: 467.31526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)OC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)OC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H19BrN4O3/c23-15-3-1-4-18(13-15)30-22-19(5-2-10-25-22)21(29)26-16-6-8-17(9-7-16)27-12-11-24-20(28)14-27/h1-10,13H,11-12,14H2,(H,24,28)(H,26,29)