1-[4-(4-azanyl-7-bromanyl-2-propyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-propan-2-yl-urea

Systemtic Name: 1-[4-(4-azanyl-7-bromanyl-2-propyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-propan-2-yl-urea Openeye Name: 1-[4-(4-amino-7-bromo-2-propyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-isopropyl-urea CAS Name: 1-[4-(4-amino-7-bromo-2-propyl-1-imidazo[4,5-c]quinolinyl)butyl]-3-propan-2-ylurea IUPAC Name: 1-[4-(4-amino-7-bromo-2-propylimidazo[4,5-c]quinolin-1-yl)butyl]-3-propan-2-ylurea Traditional Name: 1-[4-(4-amino-7-bromo-2-propyl-imidazo[4,5-c]quinolin-1-yl)butyl]-3-isopropyl-urea Formula: C21H29BrN6O MolecularWeight: 461.39856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CCCCNC(=O)NC(C)C)C3=C(C=C(C=C3)Br)N=C2N

Isomeric SMILES

CCCC1=NC2=C(N1CCCCNC(=O)NC(C)C)C3=C(C=C(C=C3)Br)N=C2N

InChI

InChI=1S/C21H29BrN6O/c1-4-7-17-27-18-19(15-9-8-14(22)12-16(15)26-20(18)23)28(17)11-6-5-10-24-21(29)25-13(2)3/h8-9,12-13H,4-7,10-11H2,1-3H3,(H2,23,26)(H2,24,25,29)