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

Systemtic Name: 3-[(4-chloranylphenoxy)methyl]-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-chlorophenoxy)methyl]-4-(2-furylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-chlorophenoxy)methyl]-4-(2-furanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-chlorophenoxy)methyl]-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-chlorophenoxy)methyl]-4-(2-furfuryl)-1H-1,2,4-triazole-5-thione Formula: C14H12ClN3O2S MolecularWeight: 321.78198

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NNC2=S)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=COC(=C1)CN2C(=NNC2=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)