4-(3-chlorophenyl)-5-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(3-chlorophenyl)-5-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-(3-chlorophenyl)-5-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(3-chlorophenyl)-5-(5-methyl-2-nitrophenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(3-chlorophenyl)-5-(5-methyl-2-nitrophenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-(3-chlorophenyl)-5-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-thiolate Formula: C15H10ClN4O2S- MolecularWeight: 345.7835

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C2=NN=C(N2C3=CC(=CC=C3)Cl)[S-]

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])C2=NN=C(N2C3=CC(=CC=C3)Cl)[S-]

InChI

InChI=1S/C15H11ClN4O2S/c1-9-5-6-13(20(21)22)12(7-9)14-17-18-15(23)19(14)11-4-2-3-10(16)8-11/h2-8H,1H3,(H,18,23)/p-1