1-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazin-1-ium

Systemtic Name: 1-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazin-1-ium Openeye Name: 1-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazin-1-ium CAS Name: 1-methyl-3-(methylthio)-5-phenyl-1,2,4-triazin-1-ium IUPAC Name: 1-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazin-1-ium Traditional Name: 1-methyl-3-(methylthio)-5-phenyl-1,2,4-triazin-1-ium Formula: C11H12N3S+ MolecularWeight: 218.29808

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NC(=NC(=C1)C2=CC=CC=C2)SC

Isomeric SMILES

C[N+]1=NC(=NC(=C1)C2=CC=CC=C2)SC

InChI

InChI=1S/C11H12N3S/c1-14-8-10(12-11(13-14)15-2)9-6-4-3-5-7-9/h3-8H,1-2H3/q+1