4-azanyl-4-oxidanylidene-2-[2-[2-(2-sulfanylethanoylamino)ethanoylamino]ethanoylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[2-[2-(2-sulfanylethanoylamino)ethanoylamino]ethanoylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]butanoic acid CAS Name: 4-amino-2-[[2-[[2-[(2-mercapto-1-oxoethyl)amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-4-oxo-2-[[2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]butanoic acid Traditional Name: 4-amino-4-keto-2-[[2-[[2-[(2-mercaptoacetyl)amino]acetyl]amino]acetyl]amino]butyric acid Formula: C10H16N4O6S MolecularWeight: 320.32224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N4O6S/c11-6(15)1-5(10(19)20)14-8(17)3-12-7(16)2-13-9(18)4-21/h5,21H,1-4H2,(H2,11,15)(H,12,16)(H,13,18)(H,14,17)(H,19,20)