N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[4-(3-oxo-1-piperazinyl)phenyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-2-(2-thienyl)cinchoninamide Formula: C24H20N4O2S MolecularWeight: 428.5062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C24H20N4O2S/c29-23-15-28(12-11-25-23)17-9-7-16(8-10-17)26-24(30)19-14-21(22-6-3-13-31-22)27-20-5-2-1-4-18(19)20/h1-10,13-14H,11-12,15H2,(H,25,29)(H,26,30)