4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-N-[(3-methylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-N-[(3-methylphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-N-(m-tolylmethyl)piperazine-1-carboxamide CAS Name: 4-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]-N-[(3-methylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-N-[(3-methylphenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]-N-(3-methylbenzyl)piperazine-1-carboxamide Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)N2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)N2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H28N6O/c1-20-3-2-4-23(13-20)15-28-25(32)30-11-9-29(10-12-30)18-24-16-27-19-31(24)17-22-7-5-21(14-26)6-8-22/h2-8,13,16,19H,9-12,15,17-18H2,1H3,(H,28,32)