2-[2-[2-[(2-azanyl-3-sulfanyl-propanoyl)amino]propanoylamino]propanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[2-[2-[(2-azanyl-3-sulfanyl-propanoyl)amino]propanoylamino]propanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[2-[2-[(2-amino-3-sulfanyl-propanoyl)amino]propanoylamino]propanoylamino]-3-hydroxy-butanoic acid CAS Name: 2-[[2-[[2-[(2-amino-3-mercapto-1-oxopropyl)amino]-1-oxopropyl]amino]-1-oxopropyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[2-[2-[(2-amino-3-sulfanylpropanoyl)amino]propanoylamino]propanoylamino]-3-hydroxybutanoic acid Traditional Name: 2-[2-[2-[(2-amino-3-mercapto-propanoyl)amino]propanoylamino]propanoylamino]-3-hydroxy-butyric acid Formula: C13H24N4O6S MolecularWeight: 364.41786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C(C)NC(=O)C(C)NC(=O)C(CS)N)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C(C)NC(=O)C(C)NC(=O)C(CS)N)O

InChI

InChI=1S/C13H24N4O6S/c1-5(16-12(21)8(14)4-24)10(19)15-6(2)11(20)17-9(7(3)18)13(22)23/h5-9,18,24H,4,14H2,1-3H3,(H,15,19)(H,16,21)(H,17,20)(H,22,23)