2-[2-[[1,3-bis(oxidanylidene)isoindol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[[1,3-bis(oxidanylidene)isoindol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-[(1,3-dioxoisoindolin-2-yl)amino]-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-[(1,3-dioxo-2-isoindolyl)amino]-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-[(1,3-dioxoisoindol-2-yl)amino]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(phthalimidoamino)ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C15H11N4O4S- MolecularWeight: 343.33724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NN2C(=O)C3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NN2C(=O)C3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C15H12N4O4S/c1-8-6-11(20)17-15(16-8)24-7-12(21)18-19-13(22)9-4-2-3-5-10(9)14(19)23/h2-6H,7H2,1H3,(H,18,21)(H,16,17,20)/p-1