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

Systemtic Name: N-[2-ethyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: N-(2-ethyl-4-isobutyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: N-[2-ethyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: N-[2-ethyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: N-(2-ethyl-4-isobutyl-3-keto-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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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=C3)CC(C)C

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)CC(C)C

InChI

InChI=1S/C21H26N2O4S/c1-4-19-21(24)23(13-15(2)3)14-16-12-17(10-11-20(16)27-19)22-28(25,26)18-8-6-5-7-9-18/h5-12,15,19,22H,4,13-14H2,1-3H3