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

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-1-(cyanomethyl)-3-(3-pyridin-4-ylpropyl)urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-1-(cyanomethyl)-3-[3-(4-pyridyl)propyl]urea CAS Name: 1-[2-(1-adamantyl)ethyl]-1-(cyanomethyl)-3-(3-pyridin-4-ylpropyl)urea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-1-(cyanomethyl)-3-(3-pyridin-4-ylpropyl)urea Traditional Name: 1-[2-(1-adamantyl)ethyl]-1-(cyanomethyl)-3-[3-(4-pyridyl)propyl]urea Formula: C23H32N4O MolecularWeight: 380.52638

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCN(CC#N)C(=O)NCCCC4=CC=NC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCN(CC#N)C(=O)NCCCC4=CC=NC=C4

InChI

InChI=1S/C23H32N4O/c24-6-11-27(22(28)26-7-1-2-18-3-8-25-9-4-18)10-5-23-15-19-12-20(16-23)14-21(13-19)17-23/h3-4,8-9,19-21H,1-2,5,7,10-17H2,(H,26,28)