3-[2,3-bis(fluoranyl)phenyl]-1,2,4-triazole-1-carbothioamide

Systemtic Name: 3-[2,3-bis(fluoranyl)phenyl]-1,2,4-triazole-1-carbothioamide Openeye Name: 3-(2,3-difluorophenyl)-1,2,4-triazole-1-carbothioamide CAS Name: 3-(2,3-difluorophenyl)-1,2,4-triazole-1-carbothioamide IUPAC Name: 3-(2,3-difluorophenyl)-1,2,4-triazole-1-carbothioamide Traditional Name: 3-(2,3-difluorophenyl)-1,2,4-triazole-1-carbothioamide Formula: C9H6F2N4S MolecularWeight: 240.232546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)C2=NN(C=N2)C(=S)N

Isomeric SMILES

C1=CC(=C(C(=C1)F)F)C2=NN(C=N2)C(=S)N

InChI

InChI=1S/C9H6F2N4S/c10-6-3-1-2-5(7(6)11)8-13-4-15(14-8)9(12)16/h1-4H,(H2,12,16)