N-[3-[4-azanyl-2-(2-hydroxyethyl)imidazo[4,5-c]quinolin-1-yl]propyl]isoquinoline-3-carboxamide

Systemtic Name: N-[3-[4-azanyl-2-(2-hydroxyethyl)imidazo[4,5-c]quinolin-1-yl]propyl]isoquinoline-3-carboxamide Openeye Name: N-[3-[4-amino-2-(2-hydroxyethyl)imidazo[4,5-c]quinolin-1-yl]propyl]isoquinoline-3-carboxamide CAS Name: N-[3-[4-amino-2-(2-hydroxyethyl)-1-imidazo[4,5-c]quinolinyl]propyl]-3-isoquinolinecarboxamide IUPAC Name: N-[3-[4-amino-2-(2-hydroxyethyl)imidazo[4,5-c]quinolin-1-yl]propyl]isoquinoline-3-carboxamide Traditional Name: N-[3-[4-amino-2-(2-hydroxyethyl)imidazo[4,5-c]quinolin-1-yl]propyl]isoquinoline-3-carboxamide Formula: C25H24N6O2 MolecularWeight: 440.49706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C(=O)NCCCN3C(=NC4=C3C5=CC=CC=C5N=C4N)CCO

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)C(=O)NCCCN3C(=NC4=C3C5=CC=CC=C5N=C4N)CCO

InChI

InChI=1S/C25H24N6O2/c26-24-22-23(18-8-3-4-9-19(18)29-24)31(21(30-22)10-13-32)12-5-11-27-25(33)20-14-16-6-1-2-7-17(16)15-28-20/h1-4,6-9,14-15,32H,5,10-13H2,(H2,26,29)(H,27,33)