1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[(Z)-3-pyridin-4-ylprop-2-enyl]urea

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[(Z)-3-pyridin-4-ylprop-2-enyl]urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[(Z)-3-(4-pyridyl)allyl]urea CAS Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[(Z)-3-pyridin-4-ylprop-2-enyl]urea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-1-pentyl-3-[(Z)-3-pyridin-4-ylprop-2-enyl]urea Traditional Name: 1-[2-(1-adamantyl)ethyl]-1-amyl-3-[(Z)-3-(4-pyridyl)allyl]urea Formula: C26H39N3O MolecularWeight: 409.60736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NCC=CC4=CC=NC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H39N3O/c1-2-3-4-13-29(25(30)28-10-5-6-21-7-11-27-12-8-21)14-9-26-18-22-15-23(19-26)17-24(16-22)20-26/h5-8,11-12,22-24H,2-4,9-10,13-20H2,1H3,(H,28,30)/b6-5-