4-[4-azanyl-2-(ethoxymethyl)-7-pyridin-3-yl-imidazo[4,5-c]quinolin-1-yl]butane-1-sulfonamide

Systemtic Name: 4-[4-azanyl-2-(ethoxymethyl)-7-pyridin-3-yl-imidazo[4,5-c]quinolin-1-yl]butane-1-sulfonamide Openeye Name: 4-[4-amino-2-(ethoxymethyl)-7-(3-pyridyl)imidazo[4,5-c]quinolin-1-yl]butane-1-sulfonamide CAS Name: 4-[4-amino-2-(ethoxymethyl)-7-(3-pyridinyl)-1-imidazo[4,5-c]quinolinyl]-1-butanesulfonamide IUPAC Name: 4-[4-amino-2-(ethoxymethyl)-7-pyridin-3-ylimidazo[4,5-c]quinolin-1-yl]butane-1-sulfonamide Traditional Name: 4-[4-amino-2-(ethoxymethyl)-7-(3-pyridyl)imidazo[4,5-c]quinolin-1-yl]butane-1-sulfonamide Formula: C22H26N6O3S MolecularWeight: 454.54524

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=NC2=C(N1CCCCS(=O)(=O)N)C3=C(C=C(C=C3)C4=CN=CC=C4)N=C2N

Isomeric SMILES

CCOCC1=NC2=C(N1CCCCS(=O)(=O)N)C3=C(C=C(C=C3)C4=CN=CC=C4)N=C2N

InChI

InChI=1S/C22H26N6O3S/c1-2-31-14-19-27-20-21(28(19)10-3-4-11-32(24,29)30)17-8-7-15(12-18(17)26-22(20)23)16-6-5-9-25-13-16/h5-9,12-13H,2-4,10-11,14H2,1H3,(H2,23,26)(H2,24,29,30)