N-[4-(4-azanyl-2-hexyl-imidazo[4,5-c]quinolin-1-yl)butyl]methanesulfonamide

Systemtic Name: N-[4-(4-azanyl-2-hexyl-imidazo[4,5-c]quinolin-1-yl)butyl]methanesulfonamide Openeye Name: N-[4-(4-amino-2-hexyl-imidazo[4,5-c]quinolin-1-yl)butyl]methanesulfonamide CAS Name: N-[4-(4-amino-2-hexyl-1-imidazo[4,5-c]quinolinyl)butyl]methanesulfonamide IUPAC Name: N-[4-(4-amino-2-hexylimidazo[4,5-c]quinolin-1-yl)butyl]methanesulfonamide Traditional Name: N-[4-(4-amino-2-hexyl-imidazo[4,5-c]quinolin-1-yl)butyl]methanesulfonamide Formula: C21H31N5O2S MolecularWeight: 417.56814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC2=C(N1CCCCNS(=O)(=O)C)C3=CC=CC=C3N=C2N

Isomeric SMILES

CCCCCCC1=NC2=C(N1CCCCNS(=O)(=O)C)C3=CC=CC=C3N=C2N

InChI

InChI=1S/C21H31N5O2S/c1-3-4-5-6-13-18-25-19-20(16-11-7-8-12-17(16)24-21(19)22)26(18)15-10-9-14-23-29(2,27)28/h7-8,11-12,23H,3-6,9-10,13-15H2,1-2H3,(H2,22,24)