2-[2-[(3-oxidanylidene-2-sulfanyl-butanoyl)amino]propanoylamino]butanedioic acid

Systemtic Name: 2-[2-[(3-oxidanylidene-2-sulfanyl-butanoyl)amino]propanoylamino]butanedioic acid Openeye Name: 2-[2-[(3-oxo-2-sulfanyl-butanoyl)amino]propanoylamino]butanedioic acid CAS Name: 2-[[2-[(2-mercapto-1,3-dioxobutyl)amino]-1-oxopropyl]amino]butanedioic acid IUPAC Name: 2-[2-[(3-oxo-2-sulfanylbutanoyl)amino]propanoylamino]butanedioic acid Traditional Name: 2-[2-[(3-keto-2-mercapto-butanoyl)amino]propanoylamino]succinic acid Formula: C11H16N2O7S MolecularWeight: 320.31894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(C(=O)C)S

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(C(=O)C)S

InChI

InChI=1S/C11H16N2O7S/c1-4(12-10(18)8(21)5(2)14)9(17)13-6(11(19)20)3-7(15)16/h4,6,8,21H,3H2,1-2H3,(H,12,18)(H,13,17)(H,15,16)(H,19,20)