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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CCCCNC(=O)NC3=CC=CC=C3Br)C4=CC=CC=C4N=C2N

Isomeric SMILES

CCCCC1=NC2=C(N1CCCCNC(=O)NC3=CC=CC=C3Br)C4=CC=CC=C4N=C2N

InChI

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