1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(1-pyridin-4-ylpentan-3-yl)urea

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(1-pyridin-4-ylpentan-3-yl)urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-3-[1-ethyl-3-(4-pyridyl)propyl]-1-pentyl-urea CAS Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(1-pyridin-4-ylpentan-3-yl)urea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-(1-pyridin-4-ylpentan-3-yl)urea Traditional Name: 1-[2-(1-adamantyl)ethyl]-1-amyl-3-[1-ethyl-3-(4-pyridyl)propyl]urea Formula: C28H45N3O MolecularWeight: 439.6764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NC(CC)CCC4=CC=NC=C4

Isomeric SMILES

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NC(CC)CCC4=CC=NC=C4

InChI

InChI=1S/C28H45N3O/c1-3-5-6-14-31(15-11-28-19-23-16-24(20-28)18-25(17-23)21-28)27(32)30-26(4-2)8-7-22-9-12-29-13-10-22/h9-10,12-13,23-26H,3-8,11,14-21H2,1-2H3,(H,30,32)