N-[4-[4-azanyl-2-(hydroxymethyl)-7-phenyl-imidazo[4,5-c]quinolin-1-yl]butyl]methanesulfonamide

Systemtic Name: N-[4-[4-azanyl-2-(hydroxymethyl)-7-phenyl-imidazo[4,5-c]quinolin-1-yl]butyl]methanesulfonamide Openeye Name: N-[4-[4-amino-2-(hydroxymethyl)-7-phenyl-imidazo[4,5-c]quinolin-1-yl]butyl]methanesulfonamide CAS Name: N-[4-[4-amino-2-(hydroxymethyl)-7-phenyl-1-imidazo[4,5-c]quinolinyl]butyl]methanesulfonamide IUPAC Name: N-[4-[4-amino-2-(hydroxymethyl)-7-phenylimidazo[4,5-c]quinolin-1-yl]butyl]methanesulfonamide Traditional Name: N-[4-(4-amino-2-methylol-7-phenyl-imidazo[4,5-c]quinolin-1-yl)butyl]methanesulfonamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCCCN1C(=NC2=C1C3=C(C=C(C=C3)C4=CC=CC=C4)N=C2N)CO

Isomeric SMILES

CS(=O)(=O)NCCCCN1C(=NC2=C1C3=C(C=C(C=C3)C4=CC=CC=C4)N=C2N)CO

InChI

InChI=1S/C22H25N5O3S/c1-31(29,30)24-11-5-6-12-27-19(14-28)26-20-21(27)17-10-9-16(13-18(17)25-22(20)23)15-7-3-2-4-8-15/h2-4,7-10,13,24,28H,5-6,11-12,14H2,1H3,(H2,23,25)