1-phenethyl-3-[6-[[phenethyl-(phenylmethyl)carbamoyl]amino]hexyl]-1-(phenylmethyl)urea

Systemtic Name: 1-phenethyl-3-[6-[[phenethyl-(phenylmethyl)carbamoyl]amino]hexyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[6-[[benzyl(phenethyl)carbamoyl]amino]hexyl]-1-phenethyl-urea CAS Name: 3-[6-[[oxo-[phenethyl-(phenylmethyl)amino]methyl]amino]hexyl]-1-phenethyl-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[6-[[benzyl(phenethyl)carbamoyl]amino]hexyl]-1-phenethylurea Traditional Name: 1-benzyl-3-[6-[[benzyl(phenethyl)carbamoyl]amino]hexyl]-1-phenethyl-urea Formula: C38H46N4O2 MolecularWeight: 590.79744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)NCCCCCCNC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)NCCCCCCNC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C38H46N4O2/c43-37(41(31-35-21-11-5-12-22-35)29-25-33-17-7-3-8-18-33)39-27-15-1-2-16-28-40-38(44)42(32-36-23-13-6-14-24-36)30-26-34-19-9-4-10-20-34/h3-14,17-24H,1-2,15-16,25-32H2,(H,39,43)(H,40,44)