4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazole-3-thiolate CAS Name: 4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazole-3-thiolate Formula: C18H19N4O2S2- MolecularWeight: 387.49906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O2S2/c1-12-7-5-8-13(2)16(12)22-17(19-20-18(22)25)14-9-6-10-15(11-14)26(23,24)21(3)4/h5-11H,1-4H3,(H,20,25)/p-1