N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-ethyl-4-[(2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-ethyl-4-(2-fluorobenzyl)-3-keto-5H-1,4-benzoxazepin-7-yl]-4-fluoro-benzenesulfonamide Formula: C24H22F2N2O4S MolecularWeight: 472.504286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)CC4=CC=CC=C4F

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)CC4=CC=CC=C4F

InChI

InChI=1S/C24H22F2N2O4S/c1-2-22-24(29)28(14-16-5-3-4-6-21(16)26)15-17-13-19(9-12-23(17)32-22)27-33(30,31)20-10-7-18(25)8-11-20/h3-13,22,27H,2,14-15H2,1H3