2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]ethanamide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)acetamide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)acetamide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)acetamide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)acetamide Formula: C15H16N5O3S+ MolecularWeight: 346.38424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NC(=O)CSC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NC(=O)CSC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C15H15N5O3S/c1-19-11(7-13(22)20(2)15(19)23)18-12(21)8-24-14-16-9-5-3-4-6-10(9)17-14/h3-7H,8H2,1-2H3,(H,16,17)(H,18,21)/p+1