1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(3-quinolin-4-ylpropyl)urea

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(3-quinolin-4-ylpropyl)urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[3-(4-quinolyl)propyl]urea CAS Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[3-(4-quinolinyl)propyl]urea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(3-quinolin-4-ylpropyl)urea Traditional Name: 1-[2-(1-adamantyl)ethyl]-1-amyl-3-[3-(4-quinolyl)propyl]urea Formula: C30H43N3O MolecularWeight: 461.68192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NCCCC4=CC=NC5=CC=CC=C45

Isomeric SMILES

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NCCCC4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C30H43N3O/c1-2-3-6-15-33(16-12-30-20-23-17-24(21-30)19-25(18-23)22-30)29(34)32-13-7-8-26-11-14-31-28-10-5-4-9-27(26)28/h4-5,9-11,14,23-25H,2-3,6-8,12-13,15-22H2,1H3,(H,32,34)