4-methyl-3-oxidanylidene-1-(phenylmethylsulfanyl)-2H-1,3,5-triazine-1,3-diium-2-amine

Systemtic Name: 4-methyl-3-oxidanylidene-1-(phenylmethylsulfanyl)-2H-1,3,5-triazine-1,3-diium-2-amine Openeye Name: 1-benzylsulfanyl-4-methyl-3-oxo-2H-1,3,5-triazine-1,3-diium-2-amine CAS Name: 4-methyl-3-oxo-1-(phenylmethylthio)-2H-1,3,5-triazine-1,3-diium-2-amine IUPAC Name: 1-benzylsulfanyl-4-methyl-3-oxo-2H-1,3,5-triazine-1,3-diium-2-amine Traditional Name: [1-(benzylthio)-3-keto-4-methyl-2H-s-triazine-1,3-diium-2-yl]amine Formula: C11H14N4OS+2 MolecularWeight: 250.32006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=[N+](C([N+]1=O)N)SCC2=CC=CC=C2

Isomeric SMILES

CC1=NC=[N+](C([N+]1=O)N)SCC2=CC=CC=C2

InChI

InChI=1S/C11H14N4OS/c1-9-13-8-14(11(12)15(9)16)17-7-10-5-3-2-4-6-10/h2-6,8,11H,7,12H2,1H3/q+2