5-[(3-methylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[(3-methylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[(3-methylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(3-methylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[(3-methylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(3-methylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C16H14N3OS- MolecularWeight: 296.36686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NN=C(N2C3=CC=CC=C3)[S-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NN=C(N2C3=CC=CC=C3)[S-]

InChI

InChI=1S/C16H15N3OS/c1-12-6-5-9-14(10-12)20-11-15-17-18-16(21)19(15)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,18,21)/p-1