4-[[(8-oxidanylquinolin-7-yl)-pyridin-4-yl-methyl]amino]benzenesulfonamide

Systemtic Name: 4-[[(8-oxidanylquinolin-7-yl)-pyridin-4-yl-methyl]amino]benzenesulfonamide Openeye Name: 4-[[(8-hydroxy-7-quinolyl)-(4-pyridyl)methyl]amino]benzenesulfonamide CAS Name: 4-[[(8-hydroxy-7-quinolinyl)-pyridin-4-ylmethyl]amino]benzenesulfonamide IUPAC Name: 4-[[(8-hydroxyquinolin-7-yl)-pyridin-4-ylmethyl]amino]benzenesulfonamide Traditional Name: 4-[[(8-hydroxy-7-quinolyl)-(4-pyridyl)methyl]amino]benzenesulfonamide Formula: C21H18N4O3S MolecularWeight: 406.45762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2)C(C3=CC=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)O)N=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2)C(C3=CC=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)O)N=C1

InChI

InChI=1S/C21H18N4O3S/c22-29(27,28)17-6-4-16(5-7-17)25-19(15-9-12-23-13-10-15)18-8-3-14-2-1-11-24-20(14)21(18)26/h1-13,19,25-26H,(H2,22,27,28)