[2,5-bis(oxidanylidene)-4-(phenylcarbonyl)-3-sulfanyl-pyrrolidin-3-yl] ethanoate

Systemtic Name: [2,5-bis(oxidanylidene)-4-(phenylcarbonyl)-3-sulfanyl-pyrrolidin-3-yl] ethanoate Openeye Name: (4-benzoyl-2,5-dioxo-3-sulfanyl-pyrrolidin-3-yl) acetate CAS Name: acetic acid (4-benzoyl-3-mercapto-2,5-dioxo-3-pyrrolidinyl) ester IUPAC Name: (4-benzoyl-2,5-dioxo-3-sulfanylpyrrolidin-3-yl) acetate Traditional Name: acetic acid (4-benzoyl-2,5-diketo-3-mercapto-pyrrolidin-3-yl) ester Formula: C13H11NO5S MolecularWeight: 293.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(C(=O)NC1=O)C(=O)C2=CC=CC=C2)S

Isomeric SMILES

CC(=O)OC1(C(C(=O)NC1=O)C(=O)C2=CC=CC=C2)S

InChI

InChI=1S/C13H11NO5S/c1-7(15)19-13(20)9(11(17)14-12(13)18)10(16)8-5-3-2-4-6-8/h2-6,9,20H,1H3,(H,14,17,18)