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

Systemtic Name: N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-2-propan-2-yl-quinoline-4-carboxamide Openeye Name: 2-isopropyl-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]quinoline-4-carboxamide CAS Name: N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-2-propan-2-yl-4-quinolinecarboxamide IUPAC Name: N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]-2-propan-2-ylquinoline-4-carboxamide Traditional Name: 2-isopropyl-N-[4-(3-ketopiperazino)benzyl]cinchoninamide Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C24H26N4O2/c1-16(2)22-13-20(19-5-3-4-6-21(19)27-22)24(30)26-14-17-7-9-18(10-8-17)28-12-11-25-23(29)15-28/h3-10,13,16H,11-12,14-15H2,1-2H3,(H,25,29)(H,26,30)