2-[3-[(3-oxidanylidene-2-sulfanyl-butanoyl)amino]propanoylamino]butanedioic acid

Systemtic Name: 2-[3-[(3-oxidanylidene-2-sulfanyl-butanoyl)amino]propanoylamino]butanedioic acid Openeye Name: 2-[3-[(3-oxo-2-sulfanyl-butanoyl)amino]propanoylamino]butanedioic acid CAS Name: 2-[[3-[(2-mercapto-1,3-dioxobutyl)amino]-1-oxopropyl]amino]butanedioic acid IUPAC Name: 2-[3-[(3-oxo-2-sulfanylbutanoyl)amino]propanoylamino]butanedioic acid Traditional Name: 2-[3-[(3-keto-2-mercapto-butanoyl)amino]propanoylamino]succinic acid Formula: C11H16N2O7S MolecularWeight: 320.31894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)NCCC(=O)NC(CC(=O)O)C(=O)O)S

Isomeric SMILES

CC(=O)C(C(=O)NCCC(=O)NC(CC(=O)O)C(=O)O)S

InChI

InChI=1S/C11H16N2O7S/c1-5(14)9(21)10(18)12-3-2-7(15)13-6(11(19)20)4-8(16)17/h6,9,21H,2-4H2,1H3,(H,12,18)(H,13,15)(H,16,17)(H,19,20)