N-[4-[3,6-bis(oxidanylidene)pyridazin-1-ium-1-yl]-6-methyl-pyrimidin-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[3,6-bis(oxidanylidene)pyridazin-1-ium-1-yl]-6-methyl-pyrimidin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-(3,6-dioxopyridazin-1-ium-1-yl)-6-methyl-pyrimidin-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[4-(3,6-dioxo-1-pyridazin-1-iumyl)-6-methyl-2-pyrimidinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-(3,6-dioxopyridazin-1-ium-1-yl)-6-methylpyrimidin-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[4-(3,6-diketopyridazin-1-ium-1-yl)-6-methyl-pyrimidin-2-yl]-4-methyl-benzenesulfonamide Formula: C16H14N5O4S+ MolecularWeight: 372.37846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)[N+]3=NC(=O)C=CC3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)[N+]3=NC(=O)C=CC3=O)C

InChI

InChI=1S/C16H14N5O4S/c1-10-3-5-12(6-4-10)26(24,25)20-16-17-11(2)9-13(18-16)21-15(23)8-7-14(22)19-21/h3-9H,1-2H3,(H,17,18,20)/q+1