3-fluoranyl-4-methyl-N-(2-methyl-3-oxidanylidene-4-phenethyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methyl-N-(2-methyl-3-oxidanylidene-4-phenethyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Openeye Name: 3-fluoro-4-methyl-N-(2-methyl-3-oxo-4-phenethyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: 3-fluoro-4-methyl-N-(2-methyl-3-oxo-4-phenethyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide IUPAC Name: 3-fluoro-4-methyl-N-(2-methyl-3-oxo-4-phenethyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Traditional Name: 3-fluoro-N-(3-keto-2-methyl-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-4-methyl-benzenesulfonamide Formula: C25H25FN2O4S MolecularWeight: 468.540403

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)CCC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)CCC4=CC=CC=C4

InChI

InChI=1S/C25H25FN2O4S/c1-17-8-10-22(15-23(17)26)33(30,31)27-21-9-11-24-20(14-21)16-28(25(29)18(2)32-24)13-12-19-6-4-3-5-7-19/h3-11,14-15,18,27H,12-13,16H2,1-2H3