4-(5-chloranyl-2-methoxy-phenyl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(5-chloranyl-2-methoxy-phenyl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(5-chloro-2-methoxy-phenyl)-5-[(2R)-tetrahydrofuran-2-yl]-1,2,4-triazole-3-thiolate CAS Name: 4-(5-chloro-2-methoxyphenyl)-5-[(2R)-2-oxolanyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(5-chloro-2-methoxyphenyl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(5-chloro-2-methoxy-phenyl)-5-[(2R)-tetrahydrofuran-2-yl]-1,2,4-triazole-3-thiolate Formula: C13H13ClN3O2S- MolecularWeight: 310.77922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C(=NN=C2[S-])C3CCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C(=NN=C2[S-])[C@H]3CCCO3

InChI

InChI=1S/C13H14ClN3O2S/c1-18-10-5-4-8(14)7-9(10)17-12(15-16-13(17)20)11-3-2-6-19-11/h4-5,7,11H,2-3,6H2,1H3,(H,16,20)/p-1/t11-/m1/s1