2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanethioamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanethioamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)propanethioamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanethioamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)propanethioamide Traditional Name: 2-phthalimidothiopropionamide Formula: C11H10N2O2S MolecularWeight: 234.2743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=S)N)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C(=S)N)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C11H10N2O2S/c1-6(9(12)16)13-10(14)7-4-2-3-5-8(7)11(13)15/h2-6H,1H3,(H2,12,16)