4-(phenylmethylsulfanyl)-2H-1,3,5-triazin-1-ium 1-oxide

Systemtic Name: 4-(phenylmethylsulfanyl)-2H-1,3,5-triazin-1-ium 1-oxide Openeye Name: 4-benzylsulfanyl-2H-1,3,5-triazin-1-ium 1-oxide CAS Name: 4-(phenylmethylthio)-2H-1,3,5-triazin-1-ium 1-oxide IUPAC Name: 4-benzylsulfanyl-2H-1,3,5-triazin-1-ium 1-oxide Traditional Name: 4-(benzylthio)-2H-s-triazin-1-ium 1-oxide Formula: C10H10N3OS+ MolecularWeight: 220.2709

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Descriptors Computed from Structure

Canonical SMILES:

C1N=C(N=C[N+]1=O)SCC2=CC=CC=C2

Isomeric SMILES

C1N=C(N=C[N+]1=O)SCC2=CC=CC=C2

InChI

InChI=1S/C10H10N3OS/c14-13-7-11-10(12-8-13)15-6-9-4-2-1-3-5-9/h1-5,7H,6,8H2/q+1