2-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoylamino]-2-ethanoylsulfanyl-4-methyl-pentanoic acid; 2-pyridin-2-ylethanamide

Systemtic Name: 2-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoylamino]-2-ethanoylsulfanyl-4-methyl-pentanoic acid; 2-pyridin-2-ylethanamide Openeye Name: 2-acetylsulfanyl-2-[5-(1,3-dioxoisoindolin-2-yl)pentanoylamino]-4-methyl-pentanoic acid; 2-(2-pyridyl)acetamide CAS Name: 2-(acetylthio)-2-[[5-(1,3-dioxo-2-isoindolyl)-1-oxopentyl]amino]-4-methylpentanoic acid; 2-(2-pyridinyl)acetamide IUPAC Name: 2-acetylsulfanyl-2-[5-(1,3-dioxoisoindol-2-yl)pentanoylamino]-4-methylpentanoic acid; 2-pyridin-2-ylacetamide Traditional Name: 2-(acetylthio)-4-methyl-2-(5-phthalimidopentanoylamino)valeric acid; 2-(2-pyridyl)acetamide Formula: C28H34N4O7S MolecularWeight: 570.65716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)(NC(=O)CCCCN1C(=O)C2=CC=CC=C2C1=O)SC(=O)C.C1=CC=NC(=C1)CC(=O)N

Isomeric SMILES

CC(C)CC(C(=O)O)(NC(=O)CCCCN1C(=O)C2=CC=CC=C2C1=O)SC(=O)C.C1=CC=NC(=C1)CC(=O)N

InChI

InChI=1S/C21H26N2O6S.C7H8N2O/c1-13(2)12-21(20(28)29,30-14(3)24)22-17(25)10-6-7-11-23-18(26)15-8-4-5-9-16(15)19(23)27;8-7(10)5-6-3-1-2-4-9-6/h4-5,8-9,13H,6-7,10-12H2,1-3H3,(H,22,25)(H,28,29);1-4H,5H2,(H2,8,10)