3-(2-chloranyl-5-methylsulfanyl-phenyl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-chloranyl-5-methylsulfanyl-phenyl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-chloro-5-methylsulfanyl-phenyl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-chloro-5-(methylthio)phenyl]-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-chloro-5-methylsulfanylphenyl)-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-chloro-5-(methylthio)phenyl]-4-(2,5-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C17H16ClN3O2S2 MolecularWeight: 393.91084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C17H16ClN3O2S2/c1-22-10-4-7-15(23-2)14(8-10)21-16(19-20-17(21)24)12-9-11(25-3)5-6-13(12)18/h4-9H,1-3H3,(H,20,24)