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

Systemtic Name: N-[2-ethyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-fluoro-benzenesulfonamide CAS Name: N-[2-ethyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-4-fluorobenzenesulfonamide IUPAC Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-fluorobenzenesulfonamide Traditional Name: N-(4-benzyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)-4-fluoro-benzenesulfonamide Formula: C24H23FN2O4S MolecularWeight: 454.513823

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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=C4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)CC4=CC=CC=C4

InChI

InChI=1S/C24H23FN2O4S/c1-2-22-24(28)27(15-17-6-4-3-5-7-17)16-18-14-20(10-13-23(18)31-22)26-32(29,30)21-11-8-19(25)9-12-21/h3-14,22,26H,2,15-16H2,1H3