4-[(2-fluoranyl-6-nitro-phenyl)methylsulfanyl]pyridine-2-carbothioamide

Systemtic Name: 4-[(2-fluoranyl-6-nitro-phenyl)methylsulfanyl]pyridine-2-carbothioamide Openeye Name: 4-[(2-fluoro-6-nitro-phenyl)methylsulfanyl]pyridine-2-carbothioamide CAS Name: 4-[(2-fluoro-6-nitrophenyl)methylthio]-2-pyridinecarbothioamide IUPAC Name: 4-[(2-fluoro-6-nitrophenyl)methylsulfanyl]pyridine-2-carbothioamide Traditional Name: 4-[(2-fluoro-6-nitro-benzyl)thio]thiopicolinamide Formula: C13H10FN3O2S2 MolecularWeight: 323.365803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)CSC2=CC(=NC=C2)C(=S)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)F)CSC2=CC(=NC=C2)C(=S)N)[N+](=O)[O-]

InChI

InChI=1S/C13H10FN3O2S2/c14-10-2-1-3-12(17(18)19)9(10)7-21-8-4-5-16-11(6-8)13(15)20/h1-6H,7H2,(H2,15,20)