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

Systemtic Name: N-(4-butan-2-yl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-fluoranyl-4-methyl-benzenesulfonamide Openeye Name: 3-fluoro-4-methyl-N-(3-oxo-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: N-(4-butan-2-yl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methylbenzenesulfonamide IUPAC Name: N-(4-butan-2-yl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-4-methylbenzenesulfonamide Traditional Name: 3-fluoro-N-(3-keto-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-4-methyl-benzenesulfonamide Formula: C20H23FN2O4S MolecularWeight: 406.471023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)OCC1=O

Isomeric SMILES

CCC(C)N1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)F)OCC1=O

InChI

InChI=1S/C20H23FN2O4S/c1-4-14(3)23-11-15-9-16(6-8-19(15)27-12-20(23)24)22-28(25,26)17-7-5-13(2)18(21)10-17/h5-10,14,22H,4,11-12H2,1-3H3