N-(3-cyanophenyl)-2-fluoranyl-5-nitro-benzenecarbothioamide

Systemtic Name: N-(3-cyanophenyl)-2-fluoranyl-5-nitro-benzenecarbothioamide Openeye Name: N-(3-cyanophenyl)-2-fluoro-5-nitro-benzenecarbothioamide CAS Name: N-(3-cyanophenyl)-2-fluoro-5-nitrobenzenecarbothioamide IUPAC Name: N-(3-cyanophenyl)-2-fluoro-5-nitrobenzenecarbothioamide Traditional Name: N-(3-cyanophenyl)-2-fluoro-5-nitro-thiobenzamide Formula: C14H8FN3O2S MolecularWeight: 301.295623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)C2=C(C=CC(=C2)[N+](=O)[O-])F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)C2=C(C=CC(=C2)[N+](=O)[O-])F)C#N

InChI

InChI=1S/C14H8FN3O2S/c15-13-5-4-11(18(19)20)7-12(13)14(21)17-10-3-1-2-9(6-10)8-16/h1-7H,(H,17,21)