4-acetamido-5-[[1-(carboxymethylamino)-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-acetamido-5-[[1-(carboxymethylamino)-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-acetamido-5-[[2-(carboxymethylamino)-2-oxo-1-(sulfanylmethyl)ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-acetamido-5-[[1-(carboxymethylamino)-3-mercapto-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-acetamido-5-[[1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-acetamido-5-[[2-(carboxymethylamino)-2-keto-1-(mercaptomethyl)ethyl]amino]-5-keto-valeric acid Formula: C12H19N3O7S MolecularWeight: 349.36016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)O)C(=O)NC(CS)C(=O)NCC(=O)O

Isomeric SMILES

CC(=O)NC(CCC(=O)O)C(=O)NC(CS)C(=O)NCC(=O)O

InChI

InChI=1S/C12H19N3O7S/c1-6(16)14-7(2-3-9(17)18)12(22)15-8(5-23)11(21)13-4-10(19)20/h7-8,23H,2-5H2,1H3,(H,13,21)(H,14,16)(H,15,22)(H,17,18)(H,19,20)