2-[[4-methoxy-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[[4-methoxy-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[[4-methoxy-4-oxo-2-(sulfanylmethyl)butanoyl]amino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[2-(mercaptomethyl)-4-methoxy-1,4-dioxobutyl]amino]propanoic acid IUPAC Name: 2-[[4-methoxy-4-oxo-2-(sulfanylmethyl)butanoyl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[[4-keto-2-(mercaptomethyl)-4-methoxy-butanoyl]amino]-3-mercapto-propionic acid Formula: C9H15NO5S2 MolecularWeight: 281.3491

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO5S2/c1-15-7(11)2-5(3-16)8(12)10-6(4-17)9(13)14/h5-6,16-17H,2-4H2,1H3,(H,10,12)(H,13,14)