1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-(2-phenylphenyl)-1-(pyridin-3-ylmethyl)urea

Systemtic Name: 1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-(2-phenylphenyl)-1-(pyridin-3-ylmethyl)urea Openeye Name: 1-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-3-(2-phenylphenyl)-1-(3-pyridylmethyl)urea CAS Name: 1-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-3-(2-phenylphenyl)-1-(3-pyridinylmethyl)urea IUPAC Name: 1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-(2-phenylphenyl)-1-(pyridin-3-ylmethyl)urea Traditional Name: 1-[1-(3-cyanobenzyl)-4-piperidyl]-3-(2-phenylphenyl)-1-(3-pyridylmethyl)urea Formula: C32H31N5O MolecularWeight: 501.62144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(CC2=CN=CC=C2)C(=O)NC3=CC=CC=C3C4=CC=CC=C4)CC5=CC=CC(=C5)C#N

Isomeric SMILES

C1CN(CCC1N(CC2=CN=CC=C2)C(=O)NC3=CC=CC=C3C4=CC=CC=C4)CC5=CC=CC(=C5)C#N

InChI

InChI=1S/C32H31N5O/c33-21-25-8-6-9-26(20-25)23-36-18-15-29(16-19-36)37(24-27-10-7-17-34-22-27)32(38)35-31-14-5-4-13-30(31)28-11-2-1-3-12-28/h1-14,17,20,22,29H,15-16,18-19,23-24H2,(H,35,38)