4-[[5-[[(4-cyanophenyl)methyl-(4-phenoxyphenyl)amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[(4-cyanophenyl)methyl-(4-phenoxyphenyl)amino]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[N-[(4-cyanophenyl)methyl]-4-phenoxy-anilino]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[N-[(4-cyanophenyl)methyl]-4-phenoxyanilino]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[N-[(4-cyanophenyl)methyl]-4-phenoxyanilino]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[(N-(4-cyanobenzyl)-4-phenoxy-anilino)methyl]imidazol-1-yl]methyl]benzonitrile Formula: C32H25N5O MolecularWeight: 495.5738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CC3=CC=C(C=C3)C#N)CC4=CN=CN4CC5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CC3=CC=C(C=C3)C#N)CC4=CN=CN4CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C32H25N5O/c33-18-25-6-10-27(11-7-25)21-36(29-14-16-32(17-15-29)38-31-4-2-1-3-5-31)23-30-20-35-24-37(30)22-28-12-8-26(19-34)9-13-28/h1-17,20,24H,21-23H2