2-[2-[2-[hexyl(2-sulfanylethanoyl)amino]ethanoylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-[hexyl(2-sulfanylethanoyl)amino]ethanoylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[2-[hexyl-(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[2-[hexyl-(2-mercapto-1-oxoethyl)amino]-1-oxoethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-[hexyl-(2-sulfanylacetyl)amino]acetyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[2-[hexyl-(2-mercaptoacetyl)amino]acetyl]amino]acetyl]amino]acetic acid Formula: C14H25N3O5S MolecularWeight: 347.4304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC(=O)NCC(=O)NCC(=O)O)C(=O)CS

Isomeric SMILES

CCCCCCN(CC(=O)NCC(=O)NCC(=O)O)C(=O)CS

InChI

InChI=1S/C14H25N3O5S/c1-2-3-4-5-6-17(13(20)10-23)9-12(19)15-7-11(18)16-8-14(21)22/h23H,2-10H2,1H3,(H,15,19)(H,16,18)(H,21,22)