1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-[(3-methylphenyl)amino]piperidine-4-carboxamide

Systemtic Name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-[(3-methylphenyl)amino]piperidine-4-carboxamide Openeye Name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-(3-methylanilino)piperidine-4-carboxamide CAS Name: 1-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]-4-(3-methylanilino)-4-piperidinecarboxamide IUPAC Name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-(3-methylanilino)piperidine-4-carboxamide Traditional Name: 1-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]-4-(m-toluidino)isonipecotamide Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2(CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2(CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)C(=O)N

InChI

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