3-(2-chloranyl-5-methylsulfanyl-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-chloranyl-5-methylsulfanyl-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-chloro-5-methylsulfanyl-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-chloro-5-(methylthio)phenyl]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-chloro-5-methylsulfanylphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-chloro-5-(methylthio)phenyl]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-1,2,4-triazole-5-thione Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C2=NNC(=S)N2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C2=NNC(=S)N2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C17H14ClN3O2S2/c1-25-11-3-4-13(18)12(9-11)16-19-20-17(24)21(16)10-2-5-14-15(8-10)23-7-6-22-14/h2-5,8-9H,6-7H2,1H3,(H,20,24)