4-[(4-cyanophenyl)methyl]-N-[[2-(dimethylamino)pyridin-4-yl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(dimethylamino)pyridin-4-yl]methyl]piperazine-1-carboxamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(dimethylamino)-4-pyridyl]methyl]piperazine-1-carboxamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(dimethylamino)-4-pyridinyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-[[2-(dimethylamino)pyridin-4-yl]methyl]piperazine-1-carboxamide Traditional Name: 4-(4-cyanobenzyl)-N-[[2-(dimethylamino)-4-pyridyl]methyl]piperazine-1-carboxamide Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=CC(=C1)CNC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CN(C)C1=NC=CC(=C1)CNC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H26N6O/c1-25(2)20-13-19(7-8-23-20)15-24-21(28)27-11-9-26(10-12-27)16-18-5-3-17(14-22)4-6-18/h3-8,13H,9-12,15-16H2,1-2H3,(H,24,28)