2-[2-[2-(2-sulfanylethanoylamino)ethylcarbamothioylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-(2-sulfanylethanoylamino)ethylcarbamothioylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[2-[(2-sulfanylacetyl)amino]ethylcarbamothioylamino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[[2-[(2-mercapto-1-oxoethyl)amino]ethylamino]-sulfanylidenemethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[2-[(2-sulfanylacetyl)amino]ethylcarbamothioylamino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[2-[(2-mercaptoacetyl)amino]ethylthiocarbamoylamino]acetyl]amino]acetic acid Formula: C9H16N4O4S2 MolecularWeight: 308.37774

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC(=S)NCC(=O)NCC(=O)O)NC(=O)CS

Isomeric SMILES

C(CNC(=S)NCC(=O)NCC(=O)O)NC(=O)CS

InChI

InChI=1S/C9H16N4O4S2/c14-6(12-4-8(16)17)3-13-9(19)11-2-1-10-7(15)5-18/h18H,1-5H2,(H,10,15)(H,12,14)(H,16,17)(H2,11,13,19)