3-ethyl-4-(4-methylsulfonylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-ethyl-4-(4-methylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-(4-methylsulfonylphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-(4-methylsulfonylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-(4-methylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-(4-mesylphenyl)-1H-1,2,4-triazole-5-thione Formula: C11H13N3O2S2 MolecularWeight: 283.36982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCC1=NNC(=S)N1C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C11H13N3O2S2/c1-3-10-12-13-11(17)14(10)8-4-6-9(7-5-8)18(2,15)16/h4-7H,3H2,1-2H3,(H,13,17)