2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-sulfanyl-propanoyl]-methyl-amino]ethanoate

Systemtic Name: 2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-sulfanyl-propanoyl]-methyl-amino]ethanoate Openeye Name: 2-[[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]-3-sulfanyl-propanoyl]-methyl-amino]acetate CAS Name: 2-[[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-3-mercapto-1-oxopropyl]-methylamino]acetate IUPAC Name: 2-[[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]-3-sulfanylpropanoyl]-methylamino]acetate Traditional Name: 2-[[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]-3-mercapto-propanoyl]-methyl-amino]acetate Formula: C11H18N3O6S- MolecularWeight: 320.34212

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])C(=O)C(CS)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CN(CC(=O)[O-])C(=O)C(CS)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C11H19N3O6S/c1-14(4-9(17)18)11(20)7(5-21)13-10(19)6(12)2-3-8(15)16/h6-7,21H,2-5,12H2,1H3,(H,13,19)(H,15,16)(H,17,18)/p-1