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

Systemtic Name: N-(4-butan-2-yl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-fluoranyl-4-methyl-benzenesulfonamide Openeye Name: N-(2-ethyl-3-oxo-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methyl-benzenesulfonamide CAS Name: N-(4-butan-2-yl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methylbenzenesulfonamide IUPAC Name: N-(4-butan-2-yl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methylbenzenesulfonamide Traditional Name: N-(2-ethyl-3-keto-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methyl-benzenesulfonamide Formula: C22H27FN2O4S MolecularWeight: 434.524183

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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)C)F)C(C)CC

Isomeric SMILES

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

InChI

InChI=1S/C22H27FN2O4S/c1-5-15(4)25-13-16-11-17(8-10-21(16)29-20(6-2)22(25)26)24-30(27,28)18-9-7-14(3)19(23)12-18/h7-12,15,20,24H,5-6,13H2,1-4H3