N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-1-(2,5-dimethylphenyl)methanesulfonamide

Systemtic Name: N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-1-(2,5-dimethylphenyl)methanesulfonamide Openeye Name: 1-(2,5-dimethylphenyl)-N-(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)methanesulfonamide CAS Name: N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-1-(2,5-dimethylphenyl)methanesulfonamide IUPAC Name: N-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-1-(2,5-dimethylphenyl)methanesulfonamide Traditional Name: 1-(2,5-dimethylphenyl)-N-(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)methanesulfonamide Formula: C24H32N2O4S MolecularWeight: 444.58688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CS(=O)(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)CC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CS(=O)(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)CC(C)C

InChI

InChI=1S/C24H32N2O4S/c1-16(2)13-26-21-10-9-20(12-22(21)30-15-24(5,6)23(26)27)25-31(28,29)14-19-11-17(3)7-8-18(19)4/h7-12,16,25H,13-15H2,1-6H3