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

Systemtic Name: 1-[4-(4-azanyl-2-butyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-bromophenyl)urea Openeye Name: 1-[4-(4-amino-2-butyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-bromophenyl)urea CAS Name: 1-[4-(4-amino-2-butyl-1-imidazo[4,5-c]quinolinyl)butyl]-3-(4-bromophenyl)urea IUPAC Name: 1-[4-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-bromophenyl)urea Traditional Name: 1-[4-(4-amino-2-butyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-bromophenyl)urea Formula: C25H29BrN6O MolecularWeight: 509.44136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CCCCNC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4N=C2N

Isomeric SMILES

CCCCC1=NC2=C(N1CCCCNC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4N=C2N

InChI

InChI=1S/C25H29BrN6O/c1-2-3-10-21-31-22-23(19-8-4-5-9-20(19)30-24(22)27)32(21)16-7-6-15-28-25(33)29-18-13-11-17(26)12-14-18/h4-5,8-9,11-14H,2-3,6-7,10,15-16H2,1H3,(H2,27,30)(H2,28,29,33)