2-[(4-methylphenyl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium

Systemtic Name: 2-[(4-methylphenyl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Openeye Name: 2-(p-tolylsulfanylmethyl)-1H-imidazo[1,2-a]pyrimidin-4-ium CAS Name: 2-[[(4-methylphenyl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium IUPAC Name: 2-[(4-methylphenyl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Traditional Name: 2-[(p-tolylthio)methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Formula: C14H14N3S+ MolecularWeight: 256.34606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=C[N+]3=CC=CN=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=C[N+]3=CC=CN=C3N2

InChI

InChI=1S/C14H13N3S/c1-11-3-5-13(6-4-11)18-10-12-9-17-8-2-7-15-14(17)16-12/h2-9H,10H2,1H3/p+1