2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)isoindole-1,3-dione

Systemtic Name: 2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)isoindole-1,3-dione Openeye Name: 2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)isoindoline-1,3-dione CAS Name: 2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)isoindole-1,3-dione IUPAC Name: 2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)isoindole-1,3-dione Traditional Name: 2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)isoindoline-1,3-quinone Formula: C12H7N3O3S MolecularWeight: 273.26728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC(=O)NC(=S)N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC(=O)NC(=S)N3

InChI

InChI=1S/C12H7N3O3S/c16-9-5-8(13-12(19)14-9)15-10(17)6-3-1-2-4-7(6)11(15)18/h1-5H,(H2,13,14,16,19)