1,6-dimethyl-3-thiophen-2-yl-8H-pyrimido[5,4-e][1,2,4]triazin-1-ium-5,7-dione

Systemtic Name: 1,6-dimethyl-3-thiophen-2-yl-8H-pyrimido[5,4-e][1,2,4]triazin-1-ium-5,7-dione Openeye Name: 1,6-dimethyl-3-(2-thienyl)-8H-pyrimido[5,4-e][1,2,4]triazin-1-ium-5,7-dione CAS Name: 1,6-dimethyl-3-thiophen-2-yl-8H-pyrimido[5,4-e][1,2,4]triazin-1-ium-5,7-dione IUPAC Name: 1,6-dimethyl-3-thiophen-2-yl-8H-pyrimido[5,4-e][1,2,4]triazin-1-ium-5,7-dione Traditional Name: 1,6-dimethyl-3-(2-thienyl)-8H-pyrimido[5,4-e][1,2,4]triazin-1-ium-5,7-quinone Formula: C11H10N5O2S+ MolecularWeight: 276.2944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(NC1=O)[N+](=NC(=N2)C3=CC=CS3)C

Isomeric SMILES

CN1C(=O)C2=C(NC1=O)[N+](=NC(=N2)C3=CC=CS3)C

InChI

InChI=1S/C11H9N5O2S/c1-15-10(17)7-9(13-11(15)18)16(2)14-8(12-7)6-4-3-5-19-6/h3-5H,1-2H3/p+1