3-(5-bromanylpyridin-3-yl)-4-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-bromanylpyridin-3-yl)-4-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-bromo-3-pyridyl)-4-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-bromo-3-pyridinyl)-4-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-bromopyridin-3-yl)-4-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-bromo-3-pyridyl)-4-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazole-5-thione Formula: C14H10BrClN4OS MolecularWeight: 397.6774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)C3=CC(=CN=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)C3=CC(=CN=C3)Br

InChI

InChI=1S/C14H10BrClN4OS/c1-21-12-3-2-10(16)5-11(12)20-13(18-19-14(20)22)8-4-9(15)7-17-6-8/h2-7H,1H3,(H,19,22)