2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Openeye Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium CAS Name: 2-[[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium IUPAC Name: 2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Traditional Name: 2-[[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Formula: C15H15N5S+2 MolecularWeight: 297.3781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC3=C[N+]4=CC=CN=C4N3

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC3=C[N+]4=CC=CN=C4N3

InChI

InChI=1S/C15H13N5S/c1-10-3-4-12-13(7-10)19-15(18-12)21-9-11-8-20-6-2-5-16-14(20)17-11/h2-8H,9H2,1H3,(H,18,19)/p+2