1-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]-3-propyl-1-quinolin-4-yl-urea

Systemtic Name: 1-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]-3-propyl-1-quinolin-4-yl-urea Openeye Name: 1-(4-benzyl-4-hydroxy-1-piperidyl)-3-propyl-1-(4-quinolyl)urea CAS Name: 1-[4-hydroxy-4-(phenylmethyl)-1-piperidinyl]-3-propyl-1-(4-quinolinyl)urea IUPAC Name: 1-(4-benzyl-4-hydroxypiperidin-1-yl)-3-propyl-1-quinolin-4-ylurea Traditional Name: 1-(4-benzyl-4-hydroxy-piperidino)-3-propyl-1-(4-quinolyl)urea Formula: C25H30N4O2 MolecularWeight: 418.5313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N(C1=CC=NC2=CC=CC=C21)N3CCC(CC3)(CC4=CC=CC=C4)O

Isomeric SMILES

CCCNC(=O)N(C1=CC=NC2=CC=CC=C21)N3CCC(CC3)(CC4=CC=CC=C4)O

InChI

InChI=1S/C25H30N4O2/c1-2-15-27-24(30)29(23-12-16-26-22-11-7-6-10-21(22)23)28-17-13-25(31,14-18-28)19-20-8-4-3-5-9-20/h3-12,16,31H,2,13-15,17-19H2,1H3,(H,27,30)