6-methyl-2,4-bis(oxidanylidene)-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrimidine-5-sulfonamide

Systemtic Name: 6-methyl-2,4-bis(oxidanylidene)-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrimidine-5-sulfonamide Openeye Name: 6-methyl-2,4-dioxo-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrimidine-5-sulfonamide CAS Name: 6-methyl-2,4-dioxo-N-(4-pyridin-1-iumylmethyl)-1H-pyrimidine-5-sulfonamide IUPAC Name: 6-methyl-2,4-dioxo-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrimidine-5-sulfonamide Traditional Name: 2,4-diketo-6-methyl-N-(pyridin-1-ium-4-ylmethyl)-1H-pyrimidine-5-sulfonamide Formula: C11H13N4O4S+ MolecularWeight: 297.31032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)S(=O)(=O)NCC2=CC=[NH+]C=C2

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)S(=O)(=O)NCC2=CC=[NH+]C=C2

InChI

InChI=1S/C11H12N4O4S/c1-7-9(10(16)15-11(17)14-7)20(18,19)13-6-8-2-4-12-5-3-8/h2-5,13H,6H2,1H3,(H2,14,15,16,17)/p+1