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

Systemtic Name: 2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-sulfanyl-propanoyl]-(2-methylpropyl)amino]ethanoate Openeye Name: 2-[[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]-3-sulfanyl-propanoyl]-isobutyl-amino]acetate CAS Name: 2-[[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-3-mercapto-1-oxopropyl]-(2-methylpropyl)amino]acetate IUPAC Name: 2-[[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]-3-sulfanylpropanoyl]-(2-methylpropyl)amino]acetate Traditional Name: 2-[[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]-3-mercapto-propanoyl]-isobutyl-amino]acetate Formula: C14H24N3O6S- MolecularWeight: 362.42186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H25N3O6S/c1-8(2)5-17(6-12(20)21)14(23)10(7-24)16-13(22)9(15)3-4-11(18)19/h8-10,24H,3-7,15H2,1-2H3,(H,16,22)(H,18,19)(H,20,21)/p-1