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

Systemtic Name: 4-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(5-bromo-2-methoxy-phenyl)methyleneamino]-3-(2-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-3-(2-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(5-bromo-2-methoxy-benzylidene)amino]-3-(2-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C15H12BrN5OS MolecularWeight: 390.25768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=NN2C(=NNC2=S)C3=CC=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=N/N2C(=NNC2=S)C3=CC=CC=N3

InChI

InChI=1S/C15H12BrN5OS/c1-22-13-6-5-11(16)8-10(13)9-18-21-14(19-20-15(21)23)12-4-2-3-7-17-12/h2-9H,1H3,(H,20,23)/b18-9+