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

Systemtic Name: N-[2-[4-(4-azanyl-2-butyl-imidazo[4,5-c]quinolin-1-yl)butyl]phenyl]methanesulfonamide Openeye Name: N-[2-[4-(4-amino-2-butyl-imidazo[4,5-c]quinolin-1-yl)butyl]phenyl]methanesulfonamide CAS Name: N-[2-[4-(4-amino-2-butyl-1-imidazo[4,5-c]quinolinyl)butyl]phenyl]methanesulfonamide IUPAC Name: N-[2-[4-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)butyl]phenyl]methanesulfonamide Traditional Name: N-[2-[4-(4-amino-2-butyl-imidazo[4,5-c]quinolin-1-yl)butyl]phenyl]methanesulfonamide Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CCCCC3=CC=CC=C3NS(=O)(=O)C)C4=CC=CC=C4N=C2N

Isomeric SMILES

CCCCC1=NC2=C(N1CCCCC3=CC=CC=C3NS(=O)(=O)C)C4=CC=CC=C4N=C2N

InChI

InChI=1S/C25H31N5O2S/c1-3-4-16-22-28-23-24(19-13-6-8-15-21(19)27-25(23)26)30(22)17-10-9-12-18-11-5-7-14-20(18)29-33(2,31)32/h5-8,11,13-15,29H,3-4,9-10,12,16-17H2,1-2H3,(H2,26,27)