N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]quinoxaline-2-carboxamide

Systemtic Name: N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]quinoxaline-2-carboxamide Openeye Name: N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]quinoxaline-2-carboxamide CAS Name: N-[[2-[(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]-2-quinoxalinecarboxamide IUPAC Name: N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]quinoxaline-2-carboxamide Traditional Name: N-[2-[(4-phenylpiperazino)methyl]benzyl]quinoxaline-2-carboxamide Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2CNC(=O)C3=NC4=CC=CC=C4N=C3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2CNC(=O)C3=NC4=CC=CC=C4N=C3)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O/c33-27(26-19-28-24-12-6-7-13-25(24)30-26)29-18-21-8-4-5-9-22(21)20-31-14-16-32(17-15-31)23-10-2-1-3-11-23/h1-13,19H,14-18,20H2,(H,29,33)