3-fluoranyl-5-(2-sulfanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-5-(2-sulfanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)benzenecarbonitrile Openeye Name: 3-fluoro-5-(2-thioxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)benzonitrile CAS Name: 3-fluoro-5-(2-sulfanylidene-6-spiro[1H-3,1-benzoxazine-4,1'-cyclohexane]yl)benzonitrile IUPAC Name: 3-fluoro-5-(2-sulfanylidenespiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)benzonitrile Traditional Name: 3-fluoro-5-(2-thioxospiro[1H-3,1-benzoxazine-4,1'-cyclohexane]-6-yl)benzonitrile Formula: C20H17FN2OS MolecularWeight: 352.425183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=C(C=CC(=C3)C4=CC(=CC(=C4)C#N)F)NC(=S)O2

Isomeric SMILES

C1CCC2(CC1)C3=C(C=CC(=C3)C4=CC(=CC(=C4)C#N)F)NC(=S)O2

InChI

InChI=1S/C20H17FN2OS/c21-16-9-13(12-22)8-15(10-16)14-4-5-18-17(11-14)20(24-19(25)23-18)6-2-1-3-7-20/h4-5,8-11H,1-3,6-7H2,(H,23,25)