5-(5-chloranyl-2-methoxy-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazole-3-thiolate CAS Name: 5-(5-chloro-2-methoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazole-3-thiolate Formula: C17H13ClN3O3S- MolecularWeight: 374.82142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NN=C(N2C3=CC4=C(C=C3)OCCO4)[S-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NN=C(N2C3=CC4=C(C=C3)OCCO4)[S-]

InChI

InChI=1S/C17H14ClN3O3S/c1-22-13-4-2-10(18)8-12(13)16-19-20-17(25)21(16)11-3-5-14-15(9-11)24-7-6-23-14/h2-5,8-9H,6-7H2,1H3,(H,20,25)/p-1