5-phenyl-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-phenyl-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(2-isopropylphenyl)-5-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-phenyl-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-phenyl-4-(2-propan-2-ylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-o-cumenyl-5-phenyl-1,2,4-triazole-3-thiolate Formula: C17H16N3S- MolecularWeight: 294.39404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=NN=C2[S-])C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=NN=C2[S-])C3=CC=CC=C3

InChI

InChI=1S/C17H17N3S/c1-12(2)14-10-6-7-11-15(14)20-16(18-19-17(20)21)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,19,21)/p-1