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

Systemtic Name: 5-[(4-chloranylphenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-benzyl-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate CAS Name: 5-[(4-chlorophenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-benzyl-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-benzyl-5-[(4-chlorophenoxy)methyl]-1,2,4-triazole-3-thiolate Formula: C16H13ClN3OS- MolecularWeight: 330.81192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3OS/c17-13-6-8-14(9-7-13)21-11-15-18-19-16(22)20(15)10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,19,22)/p-1