7-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C16H15N4O2S2+ MolecularWeight: 359.4459

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C16H14N4O2S2/c1-9-7-24-16-17-10(5-14(21)20(9)16)8-23-15-18-12-4-3-11(22-2)6-13(12)19-15/h3-7H,8H2,1-2H3,(H,18,19)/p+1