3-methyl-7-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 3-methyl-7-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 3-methyl-7-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 3-methyl-7-[[(1-methyl-2-benzimidazolyl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 3-methyl-7-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 3-methyl-7-[[(1-methylbenzimidazol-2-yl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C16H15N4OS2+ MolecularWeight: 343.4465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C16H14N4OS2/c1-10-8-22-16-17-11(7-14(21)20(10)16)9-23-15-18-12-5-3-4-6-13(12)19(15)2/h3-8H,9H2,1-2H3/p+1