N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-1-naphthalen-1-yl-methanesulfonamide

Systemtic Name: N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-1-naphthalen-1-yl-methanesulfonamide Openeye Name: N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-1-(1-naphthyl)methanesulfonamide CAS Name: N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-1-(1-naphthalenyl)methanesulfonamide IUPAC Name: N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-1-naphthalen-1-ylmethanesulfonamide Traditional Name: N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)-1-(1-naphthyl)methanesulfonamide Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)CC4=CC=CC5=CC=CC=C54)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)CC4=CC=CC5=CC=CC=C54)C(=O)N2

InChI

InChI=1S/C25H20N2O4S/c1-16-9-11-24-22(13-16)26-25(28)21-14-19(10-12-23(21)31-24)27-32(29,30)15-18-7-4-6-17-5-2-3-8-20(17)18/h2-14,27H,15H2,1H3,(H,26,28)