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

Systemtic Name: 5-[(2-oxidanylphenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-benzyl-5-[(2-hydroxyphenoxy)methyl]-1,2,4-triazole-3-thiolate CAS Name: 5-[(2-hydroxyphenoxy)methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-benzyl-5-[(2-hydroxyphenoxy)methyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-benzyl-5-[(2-hydroxyphenoxy)methyl]-1,2,4-triazole-3-thiolate Formula: C16H14N3O2S- MolecularWeight: 312.36626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2[S-])COC3=CC=CC=C3O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2[S-])COC3=CC=CC=C3O

InChI

InChI=1S/C16H15N3O2S/c20-13-8-4-5-9-14(13)21-11-15-17-18-16(22)19(15)10-12-6-2-1-3-7-12/h1-9,20H,10-11H2,(H,18,22)/p-1