4-(5-chloranyl-2,4-dimethoxy-phenyl)-3-cyclopropyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(5-chloranyl-2,4-dimethoxy-phenyl)-3-cyclopropyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(5-chloro-2,4-dimethoxy-phenyl)-3-cyclopropyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(5-chloro-2,4-dimethoxyphenyl)-3-cyclopropyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(5-chloro-2,4-dimethoxyphenyl)-3-cyclopropyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(5-chloro-2,4-dimethoxy-phenyl)-3-cyclopropyl-1H-1,2,4-triazole-5-thione Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N2C(=NNC2=S)C3CC3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1N2C(=NNC2=S)C3CC3)Cl)OC

InChI

InChI=1S/C13H14ClN3O2S/c1-18-10-6-11(19-2)9(5-8(10)14)17-12(7-3-4-7)15-16-13(17)20/h5-7H,3-4H2,1-2H3,(H,16,20)