4-[1-(8-oxidanylquinolin-7-yl)ethylamino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[1-(8-oxidanylquinolin-7-yl)ethylamino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[1-(8-hydroxy-7-quinolyl)ethylamino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[1-(8-hydroxy-7-quinolinyl)ethylamino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[1-(8-hydroxyquinolin-7-yl)ethylamino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[1-(8-hydroxy-7-quinolyl)ethylamino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C2=C(C=CC=N2)C=C1)O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

CC(C1=C(C2=C(C=CC=N2)C=C1)O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C21H19N5O3S/c1-14(18-10-5-15-4-2-11-22-19(15)20(18)27)25-16-6-8-17(9-7-16)30(28,29)26-21-23-12-3-13-24-21/h2-14,25,27H,1H3,(H,23,24,26)