2-acetamido-3-[1-(4-acetamidophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-[1-(4-acetamidophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-[1-(4-acetamidophenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[[1-(4-acetamidophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoic acid IUPAC Name: 2-acetamido-3-[1-(4-acetamidophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[[1-(4-acetamidophenyl)-2,5-diketo-pyrrolidin-3-yl]thio]propionic acid Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(C(=O)O)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2C(=O)CC(C2=O)SCC(C(=O)O)NC(=O)C

InChI

InChI=1S/C17H19N3O6S/c1-9(21)18-11-3-5-12(6-4-11)20-15(23)7-14(16(20)24)27-8-13(17(25)26)19-10(2)22/h3-6,13-14H,7-8H2,1-2H3,(H,18,21)(H,19,22)(H,25,26)