1-(2-phenylphenyl)-3-[1-[3-[(3-phenyl-3-pyridin-2-ylsulfanyl-propyl)amino]propyl]piperidin-4-yl]urea

Systemtic Name: 1-(2-phenylphenyl)-3-[1-[3-[(3-phenyl-3-pyridin-2-ylsulfanyl-propyl)amino]propyl]piperidin-4-yl]urea Openeye Name: 1-(2-phenylphenyl)-3-[1-[3-[[3-phenyl-3-(2-pyridylsulfanyl)propyl]amino]propyl]-4-piperidyl]urea CAS Name: 1-(2-phenylphenyl)-3-[1-[3-[[3-phenyl-3-(2-pyridinylthio)propyl]amino]propyl]-4-piperidinyl]urea IUPAC Name: 1-(2-phenylphenyl)-3-[1-[3-[(3-phenyl-3-pyridin-2-ylsulfanylpropyl)amino]propyl]piperidin-4-yl]urea Traditional Name: 1-(2-phenylphenyl)-3-[1-[3-[[3-phenyl-3-(2-pyridylthio)propyl]amino]propyl]-4-piperidyl]urea Formula: C35H41N5OS MolecularWeight: 579.79794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC2=CC=CC=C2C3=CC=CC=C3)CCCNCCC(C4=CC=CC=C4)SC5=CC=CC=N5

Isomeric SMILES

C1CN(CCC1NC(=O)NC2=CC=CC=C2C3=CC=CC=C3)CCCNCCC(C4=CC=CC=C4)SC5=CC=CC=N5

InChI

InChI=1S/C35H41N5OS/c41-35(39-32-17-8-7-16-31(32)28-12-3-1-4-13-28)38-30-20-26-40(27-21-30)25-11-22-36-24-19-33(29-14-5-2-6-15-29)42-34-18-9-10-23-37-34/h1-10,12-18,23,30,33,36H,11,19-22,24-27H2,(H2,38,39,41)