4-tert-butyl-N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Openeye Name: 4-tert-butyl-N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 4-tert-butyl-N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)benzenesulfonamide IUPAC Name: 4-tert-butyl-N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 4-tert-butyl-N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C(=O)N2C

InChI

InChI=1S/C25H26N2O4S/c1-16-6-12-23-21(14-16)27(5)24(28)20-15-18(9-13-22(20)31-23)26-32(29,30)19-10-7-17(8-11-19)25(2,3)4/h6-15,26H,1-5H3