3-methyl-6-(phenylmethylsulfanyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium

Systemtic Name: 3-methyl-6-(phenylmethylsulfanyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium Openeye Name: 6-benzylsulfanyl-3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium CAS Name: 3-methyl-6-(phenylmethylthio)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium IUPAC Name: 6-benzylsulfanyl-3-methyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium Traditional Name: 6-(benzylthio)-3-methyl-1,2,3,4-tetrahydro-s-triazin-3-ium Formula: C11H16N3S+ MolecularWeight: 222.32984

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CNC(=NC1)SCC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CNC(=NC1)SCC2=CC=CC=C2

InChI

InChI=1S/C11H15N3S/c1-14-8-12-11(13-9-14)15-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,12,13)/p+1