7-cyano-N-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 7-cyano-N-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-7-cyano-4-oxo-1H-quinoline-3-carboxamide CAS Name: 7-cyano-N-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-7-cyano-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-[4-(4-benzhydrylpiperazino)butyl]-7-cyano-4-keto-1H-quinoline-3-carboxamide Formula: C32H33N5O2 MolecularWeight: 519.63672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C2=CNC3=C(C2=O)C=CC(=C3)C#N)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C2=CNC3=C(C2=O)C=CC(=C3)C#N)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H33N5O2/c33-22-24-13-14-27-29(21-24)35-23-28(31(27)38)32(39)34-15-7-8-16-36-17-19-37(20-18-36)30(25-9-3-1-4-10-25)26-11-5-2-6-12-26/h1-6,9-14,21,23,30H,7-8,15-20H2,(H,34,39)(H,35,38)