3-(1H-imidazol-5-yl)-2-[2-(2-sulfanylethanoylamino)ethanoylamino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[2-(2-sulfanylethanoylamino)ethanoylamino]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[[2-[(2-mercapto-1-oxoethyl)amino]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-[[2-[(2-sulfanylacetyl)amino]acetyl]amino]propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[[2-[(2-mercaptoacetyl)amino]acetyl]amino]propionic acid Formula: C10H14N4O4S MolecularWeight: 286.30756

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)O)NC(=O)CNC(=O)CS

Isomeric SMILES

C1=C(NC=N1)CC(C(=O)O)NC(=O)CNC(=O)CS

InChI

InChI=1S/C10H14N4O4S/c15-8(3-12-9(16)4-19)14-7(10(17)18)1-6-2-11-5-13-6/h2,5,7,19H,1,3-4H2,(H,11,13)(H,12,16)(H,14,15)(H,17,18)