3-fluoranyl-5-(8-fluoranyl-4,4-dimethyl-2-sulfanylidene-1H-3,1-benzoxazin-6-yl)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-5-(8-fluoranyl-4,4-dimethyl-2-sulfanylidene-1H-3,1-benzoxazin-6-yl)benzenecarbonitrile Openeye Name: 3-fluoro-5-(8-fluoro-4,4-dimethyl-2-thioxo-1H-3,1-benzoxazin-6-yl)benzonitrile CAS Name: 3-fluoro-5-(8-fluoro-4,4-dimethyl-2-sulfanylidene-1H-3,1-benzoxazin-6-yl)benzonitrile IUPAC Name: 3-fluoro-5-(8-fluoro-4,4-dimethyl-2-sulfanylidene-1H-3,1-benzoxazin-6-yl)benzonitrile Traditional Name: 3-fluoro-5-(8-fluoro-4,4-dimethyl-2-thioxo-1H-3,1-benzoxazin-6-yl)benzonitrile Formula: C17H12F2N2OS MolecularWeight: 330.351786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12F2N2OS/c1-17(2)13-6-11(7-14(19)15(13)21-16(23)22-17)10-3-9(8-20)4-12(18)5-10/h3-7H,1-2H3,(H,21,23)