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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=S)N

InChI

InChI=1S/C11H10N2O2S/c12-9(16)5-6-13-10(14)7-3-1-2-4-8(7)11(13)15/h1-4H,5-6H2,(H2,12,16)