5-[(4-chloranylphenoxy)methyl]-4-(furan-2-ylmethyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(4-chloranylphenoxy)methyl]-4-(furan-2-ylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-[(4-chlorophenoxy)methyl]-4-(2-furylmethyl)-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-chlorophenoxy)methyl]-4-(2-furanylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-[(4-chlorophenoxy)methyl]-4-(2-furfuryl)-1,2,4-triazole-3-thiolate Formula: C14H11ClN3O2S- MolecularWeight: 320.77404

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NN=C2[S-])COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=COC(=C1)CN2C(=NN=C2[S-])COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H12ClN3O2S/c15-10-3-5-11(6-4-10)20-9-13-16-17-14(21)18(13)8-12-2-1-7-19-12/h1-7H,8-9H2,(H,17,21)/p-1