4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-nitrophenyl)-4-(p-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-nitrophenyl)-4-(p-tolyl)-1,2,4-triazole-3-thiolate Formula: C15H11N4O2S- MolecularWeight: 311.33844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2[S-])C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O2S/c1-10-2-6-12(7-3-10)18-14(16-17-15(18)22)11-4-8-13(9-5-11)19(20)21/h2-9H,1H3,(H,17,22)/p-1