3-methyl-5-oxidanylidene-1-phenyl-1,2,4-triazole-4-carbodithioic acid

Systemtic Name: 3-methyl-5-oxidanylidene-1-phenyl-1,2,4-triazole-4-carbodithioic acid Openeye Name: 3-methyl-5-oxo-1-phenyl-1,2,4-triazole-4-carbodithioic acid CAS Name: 3-methyl-5-oxo-1-phenyl-1,2,4-triazole-4-carbodithioic acid IUPAC Name: 3-methyl-5-oxo-1-phenyl-1,2,4-triazole-4-carbodithioic acid Traditional Name: 5-keto-3-methyl-1-phenyl-1,2,4-triazole-4-carbodithioic acid Formula: C10H9N3OS2 MolecularWeight: 251.32796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C(=S)S)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)N1C(=S)S)C2=CC=CC=C2

InChI

InChI=1S/C10H9N3OS2/c1-7-11-13(8-5-3-2-4-6-8)9(14)12(7)10(15)16/h2-6H,1H3,(H,15,16)