1-(1-adamantyl)-3-[2-(4-azanyl-2-butyl-imidazo[4,5-c]quinolin-1-yl)ethyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[2-(4-azanyl-2-butyl-imidazo[4,5-c]quinolin-1-yl)ethyl]urea Openeye Name: 1-(1-adamantyl)-3-[2-(4-amino-2-butyl-imidazo[4,5-c]quinolin-1-yl)ethyl]urea CAS Name: 1-(1-adamantyl)-3-[2-(4-amino-2-butyl-1-imidazo[4,5-c]quinolinyl)ethyl]urea IUPAC Name: 1-(1-adamantyl)-3-[2-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)ethyl]urea Traditional Name: 1-(1-adamantyl)-3-[2-(4-amino-2-butyl-imidazo[4,5-c]quinolin-1-yl)ethyl]urea Formula: C27H36N6O MolecularWeight: 460.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CCNC(=O)NC34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6N=C2N

Isomeric SMILES

CCCCC1=NC2=C(N1CCNC(=O)NC34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6N=C2N

InChI

InChI=1S/C27H36N6O/c1-2-3-8-22-31-23-24(20-6-4-5-7-21(20)30-25(23)28)33(22)10-9-29-26(34)32-27-14-17-11-18(15-27)13-19(12-17)16-27/h4-7,17-19H,2-3,8-16H2,1H3,(H2,28,30)(H2,29,32,34)