1-[2-(1-adamantyl)ethyl]-1-(cyclopropylmethyl)-3-(3-pyridin-4-ylpropyl)urea

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-1-(cyclopropylmethyl)-3-(3-pyridin-4-ylpropyl)urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-1-(cyclopropylmethyl)-3-[3-(4-pyridyl)propyl]urea CAS Name: 1-[2-(1-adamantyl)ethyl]-1-(cyclopropylmethyl)-3-(3-pyridin-4-ylpropyl)urea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-1-(cyclopropylmethyl)-3-(3-pyridin-4-ylpropyl)urea Traditional Name: 1-[2-(1-adamantyl)ethyl]-1-(cyclopropylmethyl)-3-[3-(4-pyridyl)propyl]urea Formula: C25H37N3O MolecularWeight: 395.58078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CCC23CC4CC(C2)CC(C4)C3)C(=O)NCCCC5=CC=NC=C5

Isomeric SMILES

C1CC1CN(CCC23CC4CC(C2)CC(C4)C3)C(=O)NCCCC5=CC=NC=C5

InChI

InChI=1S/C25H37N3O/c29-24(27-8-1-2-19-5-9-26-10-6-19)28(18-20-3-4-20)11-7-25-15-21-12-22(16-25)14-23(13-21)17-25/h5-6,9-10,20-23H,1-4,7-8,11-18H2,(H,27,29)