2-cyano-N-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide

Systemtic Name: 2-cyano-N-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: 2-cyano-N-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: 2-cyano-N-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: 2-cyano-N-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: 2-cyano-N-[4-(4-fluorobenzyl)-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Formula: C24H20FN3O4S MolecularWeight: 465.496703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3C#N)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3C#N)CC4=CC=C(C=C4)F

InChI

InChI=1S/C24H20FN3O4S/c1-16-24(29)28(14-17-6-8-20(25)9-7-17)15-19-12-21(10-11-22(19)32-16)27-33(30,31)23-5-3-2-4-18(23)13-26/h2-12,16,27H,14-15H2,1H3