3-cyclooctyl-1-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-cyclooctyl-1-(3-morpholinopropyl)-1-(2-pyridylmethyl)thiourea CAS Name: 3-cyclooctyl-1-[3-(4-morpholinyl)propyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-cyclooctyl-1-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-cyclooctyl-1-(3-morpholinopropyl)-1-(2-pyridylmethyl)thiourea Formula: C22H36N4OS MolecularWeight: 404.61244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=N3

Isomeric SMILES

C1CCCC(CCC1)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=N3

InChI

InChI=1S/C22H36N4OS/c28-22(24-20-9-4-2-1-3-5-10-20)26(19-21-11-6-7-12-23-21)14-8-13-25-15-17-27-18-16-25/h6-7,11-12,20H,1-5,8-10,13-19H2,(H,24,28)