1-methyl-3-methylsulfanyl-4-phenyl-1,2,4-triazol-4-ium

Systemtic Name: 1-methyl-3-methylsulfanyl-4-phenyl-1,2,4-triazol-4-ium Openeye Name: 1-methyl-3-methylsulfanyl-4-phenyl-1,2,4-triazol-4-ium CAS Name: 1-methyl-3-(methylthio)-4-phenyl-1,2,4-triazol-4-ium IUPAC Name: 1-methyl-3-methylsulfanyl-4-phenyl-1,2,4-triazol-4-ium Traditional Name: 1-methyl-3-(methylthio)-4-phenyl-1,2,4-triazol-4-ium Formula: C10H12N3S+ MolecularWeight: 206.28738

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C(=N1)SC)C2=CC=CC=C2

Isomeric SMILES

CN1C=[N+](C(=N1)SC)C2=CC=CC=C2

InChI

InChI=1S/C10H12N3S/c1-12-8-13(10(11-12)14-2)9-6-4-3-5-7-9/h3-8H,1-2H3/q+1