1-(2-phenylphenyl)-3-[1-[3-(2-pyridin-3-ylpiperidin-1-yl)propyl]piperidin-4-yl]urea

Systemtic Name: 1-(2-phenylphenyl)-3-[1-[3-(2-pyridin-3-ylpiperidin-1-yl)propyl]piperidin-4-yl]urea Openeye Name: 1-(2-phenylphenyl)-3-[1-[3-[2-(3-pyridyl)-1-piperidyl]propyl]-4-piperidyl]urea CAS Name: 1-(2-phenylphenyl)-3-[1-[3-[2-(3-pyridinyl)-1-piperidinyl]propyl]-4-piperidinyl]urea IUPAC Name: 1-(2-phenylphenyl)-3-[1-[3-(2-pyridin-3-ylpiperidin-1-yl)propyl]piperidin-4-yl]urea Traditional Name: 1-(2-phenylphenyl)-3-[1-[3-[2-(3-pyridyl)piperidino]propyl]-4-piperidyl]urea Formula: C31H39N5O MolecularWeight: 497.67426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)CCCN3CCC(CC3)NC(=O)NC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)CCCN3CCC(CC3)NC(=O)NC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C31H39N5O/c37-31(34-29-14-5-4-13-28(29)25-10-2-1-3-11-25)33-27-16-22-35(23-17-27)19-9-21-36-20-7-6-15-30(36)26-12-8-18-32-24-26/h1-5,8,10-14,18,24,27,30H,6-7,9,15-17,19-23H2,(H2,33,34,37)