1-methyl-2-[(3-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylsulfanyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-methyl-2-[(3-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylsulfanyl]benzimidazole-5-sulfonamide Openeye Name: 1-methyl-2-[(3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: 1-methyl-2-[(3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylthio]-5-benzimidazolesulfonamide IUPAC Name: 1-methyl-2-[(3-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylsulfanyl]benzimidazole-5-sulfonamide Traditional Name: 2-[(5-keto-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methylthio]-1-methyl-benzimidazole-5-sulfonamide Formula: C16H16N5O3S3+ MolecularWeight: 422.52494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=C(N3C)C=CC(=C4)S(=O)(=O)N

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=C(N3C)C=CC(=C4)S(=O)(=O)N

InChI

InChI=1S/C16H15N5O3S3/c1-9-7-25-16-18-10(5-14(22)21(9)16)8-26-15-19-12-6-11(27(17,23)24)3-4-13(12)20(15)2/h3-7H,8H2,1-2H3,(H2,17,23,24)/p+1