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

Systemtic Name: 1-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]carbonyl-4-[(3-methylphenyl)methyl]piperidine-4-carbonitrile Openeye Name: 1-[3-[(4-cyanophenyl)methyl]imidazole-4-carbonyl]-4-(m-tolylmethyl)piperidine-4-carbonitrile CAS Name: 1-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]-oxomethyl]-4-[(3-methylphenyl)methyl]-4-piperidinecarbonitrile IUPAC Name: 1-[3-[(4-cyanophenyl)methyl]imidazole-4-carbonyl]-4-[(3-methylphenyl)methyl]piperidine-4-carbonitrile Traditional Name: 1-[3-(4-cyanobenzyl)imidazole-4-carbonyl]-4-(3-methylbenzyl)isonipecotonitrile Formula: C26H25N5O MolecularWeight: 423.5096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2(CCN(CC2)C(=O)C3=CN=CN3CC4=CC=C(C=C4)C#N)C#N

Isomeric SMILES

CC1=CC(=CC=C1)CC2(CCN(CC2)C(=O)C3=CN=CN3CC4=CC=C(C=C4)C#N)C#N

InChI

InChI=1S/C26H25N5O/c1-20-3-2-4-23(13-20)14-26(18-28)9-11-30(12-10-26)25(32)24-16-29-19-31(24)17-22-7-5-21(15-27)6-8-22/h2-8,13,16,19H,9-12,14,17H2,1H3