7-[3,5-bis(fluoranyl)phenyl]-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one

Systemtic Name: 7-[3,5-bis(fluoranyl)phenyl]-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one Openeye Name: 7-(3,5-difluorophenyl)-5-methyl-5-(2-thienyl)-1H-4,1-benzoxazepin-2-one CAS Name: 7-(3,5-difluorophenyl)-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one IUPAC Name: 7-(3,5-difluorophenyl)-5-methyl-5-thiophen-2-yl-1H-4,1-benzoxazepin-2-one Traditional Name: 7-(3,5-difluorophenyl)-5-methyl-5-(2-thienyl)-1H-4,1-benzoxazepin-2-one Formula: C20H15F2NO2S MolecularWeight: 371.400406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)F)F)NC(=O)CO1)C4=CC=CS4

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)F)F)NC(=O)CO1)C4=CC=CS4

InChI

InChI=1S/C20H15F2NO2S/c1-20(18-3-2-6-26-18)16-9-12(13-7-14(21)10-15(22)8-13)4-5-17(16)23-19(24)11-25-20/h2-10H,11H2,1H3,(H,23,24)