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

Systemtic Name: N-[3-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]carbamoyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[[4-(3-oxopiperazin-1-yl)phenyl]carbamoyl]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[oxo-[4-(3-oxo-1-piperazinyl)anilino]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[[4-(3-oxopiperazin-1-yl)phenyl]carbamoyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[[4-(3-ketopiperazino)phenyl]carbamoyl]phenyl]nicotinamide Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H21N5O3/c29-21-15-28(12-11-25-21)20-8-6-18(7-9-20)26-22(30)16-3-1-5-19(13-16)27-23(31)17-4-2-10-24-14-17/h1-10,13-14H,11-12,15H2,(H,25,29)(H,26,30)(H,27,31)