3-azanyl-N-[1,3-bis(oxidanylidene)isoindol-5-yl]-3-sulfanylidene-propanamide

Systemtic Name: 3-azanyl-N-[1,3-bis(oxidanylidene)isoindol-5-yl]-3-sulfanylidene-propanamide Openeye Name: 3-amino-N-(1,3-dioxoisoindolin-5-yl)-3-thioxo-propanamide CAS Name: 3-amino-N-(1,3-dioxo-5-isoindolyl)-3-sulfanylidenepropanamide IUPAC Name: 3-amino-N-(1,3-dioxoisoindol-5-yl)-3-sulfanylidenepropanamide Traditional Name: 3-amino-N-(1,3-diketoisoindolin-5-yl)-3-thioxo-propionamide Formula: C11H9N3O3S MolecularWeight: 263.27246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CC(=S)N)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CC(=S)N)C(=O)NC2=O

InChI

InChI=1S/C11H9N3O3S/c12-8(18)4-9(15)13-5-1-2-6-7(3-5)11(17)14-10(6)16/h1-3H,4H2,(H2,12,18)(H,13,15)(H,14,16,17)