4-fluoranyl-N-[3-[[5-methoxy-2-(oxan-4-ylmethyl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-[[5-methoxy-2-(oxan-4-ylmethyl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-[5-methoxy-2-(tetrahydropyran-4-ylmethyl)anilino]quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-[5-methoxy-2-(4-oxanylmethyl)anilino]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-[5-methoxy-2-(oxan-4-ylmethyl)anilino]quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-[5-methoxy-2-(tetrahydropyran-4-ylmethyl)anilino]quinoxalin-2-yl]benzenesulfonamide Formula: C27H27FN4O4S MolecularWeight: 522.591083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC2CCOCC2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC(=C(C=C1)CC2CCOCC2)NC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H27FN4O4S/c1-35-21-9-6-19(16-18-12-14-36-15-13-18)25(17-21)31-26-27(30-24-5-3-2-4-23(24)29-26)32-37(33,34)22-10-7-20(28)8-11-22/h2-11,17-18H,12-16H2,1H3,(H,29,31)(H,30,32)