2-(2-oxidanylidene-6-sulfanylidene-piperidin-3-yl)isoindole-1,3-dione

Systemtic Name: 2-(2-oxidanylidene-6-sulfanylidene-piperidin-3-yl)isoindole-1,3-dione Openeye Name: 2-(2-oxo-6-thioxo-3-piperidyl)isoindoline-1,3-dione CAS Name: 2-(2-oxo-6-sulfanylidene-3-piperidinyl)isoindole-1,3-dione IUPAC Name: 2-(2-oxo-6-sulfanylidenepiperidin-3-yl)isoindole-1,3-dione Traditional Name: 2-(2-keto-6-thioxo-3-piperidyl)isoindoline-1,3-quinone Formula: C13H10N2O3S MolecularWeight: 274.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=S)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CC(=S)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H10N2O3S/c16-11-9(5-6-10(19)14-11)15-12(17)7-3-1-2-4-8(7)13(15)18/h1-4,9H,5-6H2,(H,14,16,19)