4-[(E)-(5-bromanyl-2-fluoranyl-phenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(5-bromanyl-2-fluoranyl-phenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(5-bromo-2-fluoro-phenyl)methyleneamino]-3-(2-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(5-bromo-2-fluorophenyl)methylideneamino]-3-(2-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(5-bromo-2-fluorophenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(5-bromo-2-fluoro-benzylidene)amino]-3-(2-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C14H9BrFN5S MolecularWeight: 378.222163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NNC(=S)N2N=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1=CC=NC(=C1)C2=NNC(=S)N2/N=C/C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C14H9BrFN5S/c15-10-4-5-11(16)9(7-10)8-18-21-13(19-20-14(21)22)12-3-1-2-6-17-12/h1-8H,(H,20,22)/b18-8+