2-[(2-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium

Systemtic Name: 2-[(2-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Openeye Name: 2-[(2-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium CAS Name: 2-[[(2-methyl-1,2,4-triazol-3-yl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium IUPAC Name: 2-[(2-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Traditional Name: 2-[[(2-methyl-1,2,4-triazol-3-yl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Formula: C10H11N6S+ MolecularWeight: 247.29954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)SCC2=C[N+]3=CC=CN=C3N2

Isomeric SMILES

CN1C(=NC=N1)SCC2=C[N+]3=CC=CN=C3N2

InChI

InChI=1S/C10H10N6S/c1-15-10(12-7-13-15)17-6-8-5-16-4-2-3-11-9(16)14-8/h2-5,7H,6H2,1H3/p+1