6-[3-fluoranyl-5-(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione

Systemtic Name: 6-[3-fluoranyl-5-(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione Openeye Name: 6-[3-fluoro-5-(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione CAS Name: 6-[3-fluoro-5-(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione IUPAC Name: 6-[3-fluoro-5-(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione Traditional Name: 6-[3-fluoro-5-(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione Formula: C17H13F4NOS MolecularWeight: 355.349833

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)F)C(F)(F)F)NC(=S)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)F)C(F)(F)F)NC(=S)O1)C

InChI

InChI=1S/C17H13F4NOS/c1-16(2)13-7-9(3-4-14(13)22-15(24)23-16)10-5-11(17(19,20)21)8-12(18)6-10/h3-8H,1-2H3,(H,22,24)