1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-[(2-methylphenyl)methyl]piperidine-4-carbonitrile

Systemtic Name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-[(2-methylphenyl)methyl]piperidine-4-carbonitrile Openeye Name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-(o-tolylmethyl)piperidine-4-carbonitrile CAS Name: 1-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]-4-[(2-methylphenyl)methyl]-4-piperidinecarbonitrile IUPAC Name: 1-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]-4-[(2-methylphenyl)methyl]piperidine-4-carbonitrile Traditional Name: 1-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]-4-(2-methylbenzyl)isonipecotonitrile Formula: C26H27N5 MolecularWeight: 409.52608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2(CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)C#N

Isomeric SMILES

CC1=CC=CC=C1CC2(CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)C#N

InChI

InChI=1S/C26H27N5/c1-21-4-2-3-5-24(21)14-26(19-28)10-12-30(13-11-26)18-25-16-29-20-31(25)17-23-8-6-22(15-27)7-9-23/h2-9,16,20H,10-14,17-18H2,1H3