5,7-dimethyl-2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine

Systemtic Name: 5,7-dimethyl-2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine Openeye Name: 5,7-dimethyl-2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine CAS Name: 5,7-dimethyl-2-[[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]methyl]imidazo[1,2-a]pyrimidine IUPAC Name: 5,7-dimethyl-2-[(6-methyl-1H-benzimidazol-3-ium-2-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine Traditional Name: 5,7-dimethyl-2-[[(6-methyl-1H-benzimidazol-3-ium-2-yl)thio]methyl]imidazo[1,2-a]pyrimidine Formula: C17H18N5S+ MolecularWeight: 324.42332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC3=CN4C(=CC(=NC4=N3)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C(N2)SCC3=CN4C(=CC(=NC4=N3)C)C

InChI

InChI=1S/C17H17N5S/c1-10-4-5-14-15(6-10)21-17(20-14)23-9-13-8-22-12(3)7-11(2)18-16(22)19-13/h4-8H,9H2,1-3H3,(H,20,21)/p+1