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

Systemtic Name: 2-cyano-N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: 2-cyano-N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: 2-cyano-N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: 2-cyano-N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: 2-cyano-N-(2-ethyl-3-keto-4-p-anisyl-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3C#N)CC4=CC=C(C=C4)OC

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3C#N)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H25N3O5S/c1-3-23-26(30)29(16-18-8-11-22(33-2)12-9-18)17-20-14-21(10-13-24(20)34-23)28-35(31,32)25-7-5-4-6-19(25)15-27/h4-14,23,28H,3,16-17H2,1-2H3