2-(4-fluorophenyl)sulfanyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)ethanamide

Systemtic Name: 2-(4-fluorophenyl)sulfanyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)ethanamide Openeye Name: 2-(4-fluorophenyl)sulfanyl-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)acetamide CAS Name: 2-[(4-fluorophenyl)thio]-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)acetamide IUPAC Name: 2-(4-fluorophenyl)sulfanyl-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)acetamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)acetamide Formula: C20H21FN2O3S MolecularWeight: 388.455743

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NC(=O)CSC3=CC=C(C=C3)F)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NC(=O)CSC3=CC=C(C=C3)F)N(C1=O)C)C

InChI

InChI=1S/C20H21FN2O3S/c1-20(2)12-26-17-10-14(6-9-16(17)23(3)19(20)25)22-18(24)11-27-15-7-4-13(21)5-8-15/h4-10H,11-12H2,1-3H3,(H,22,24)