1-(3-cyanophenyl)-3-[[4-[4-(3-cyanophenyl)phenyl]-1-methyl-piperidin-4-yl]methyl]urea

Systemtic Name: 1-(3-cyanophenyl)-3-[[4-[4-(3-cyanophenyl)phenyl]-1-methyl-piperidin-4-yl]methyl]urea Openeye Name: 1-(3-cyanophenyl)-3-[[4-[4-(3-cyanophenyl)phenyl]-1-methyl-4-piperidyl]methyl]urea CAS Name: 1-(3-cyanophenyl)-3-[[4-[4-(3-cyanophenyl)phenyl]-1-methyl-4-piperidinyl]methyl]urea IUPAC Name: 1-(3-cyanophenyl)-3-[[4-[4-(3-cyanophenyl)phenyl]-1-methylpiperidin-4-yl]methyl]urea Traditional Name: 1-(3-cyanophenyl)-3-[[4-[4-(3-cyanophenyl)phenyl]-1-methyl-4-piperidyl]methyl]urea Formula: C28H27N5O MolecularWeight: 449.54688

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(CNC(=O)NC2=CC=CC(=C2)C#N)C3=CC=C(C=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN1CCC(CC1)(CNC(=O)NC2=CC=CC(=C2)C#N)C3=CC=C(C=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C28H27N5O/c1-33-14-12-28(13-15-33,20-31-27(34)32-26-7-3-5-22(17-26)19-30)25-10-8-23(9-11-25)24-6-2-4-21(16-24)18-29/h2-11,16-17H,12-15,20H2,1H3,(H2,31,32,34)