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

Systemtic Name: 2-cyano-N-[4-[(2-methoxyphenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: 2-cyano-N-[4-[(2-methoxyphenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: 2-cyano-N-[4-[(2-methoxyphenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: 2-cyano-N-[4-[(2-methoxyphenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: 2-cyano-N-(3-keto-2-methyl-4-o-anisyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C25H23N3O5S MolecularWeight: 477.53222

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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=CC=C4OC

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3C#N)CC4=CC=CC=C4OC

InChI

InChI=1S/C25H23N3O5S/c1-17-25(29)28(15-19-8-3-5-9-22(19)32-2)16-20-13-21(11-12-23(20)33-17)27-34(30,31)24-10-6-4-7-18(24)14-26/h3-13,17,27H,15-16H2,1-2H3