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

Systemtic Name: N-(4-cyclopropyl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-fluoranyl-4-methyl-benzenesulfonamide Openeye Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methyl-benzenesulfonamide CAS Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methylbenzenesulfonamide IUPAC Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methylbenzenesulfonamide Traditional Name: N-(4-cyclopropyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methyl-benzenesulfonamide Formula: C20H21FN2O4S MolecularWeight: 404.455143

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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)C4CC4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)C4CC4

InChI

InChI=1S/C20H21FN2O4S/c1-12-3-7-17(10-18(12)21)28(25,26)22-15-4-8-19-14(9-15)11-23(16-5-6-16)20(24)13(2)27-19/h3-4,7-10,13,16,22H,5-6,11H2,1-2H3