2-azanylhexanoic acid; 2-(2-thiophen-2-ylcarbonylsulfanylpropanoylamino)ethanoic acid

Systemtic Name: 2-azanylhexanoic acid; 2-(2-thiophen-2-ylcarbonylsulfanylpropanoylamino)ethanoic acid Openeye Name: 2-aminohexanoic acid; 2-[2-(thiophene-2-carbonylsulfanyl)propanoylamino]acetic acid CAS Name: 2-aminohexanoic acid; 2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]thio]propyl]amino]acetic acid IUPAC Name: 2-aminohexanoic acid; 2-[2-(thiophene-2-carbonylsulfanyl)propanoylamino]acetic acid Traditional Name: 2-aminohexanoic acid; 2-[2-(2-thenoylthio)propanoylamino]acetic acid Formula: C16H24N2O6S2 MolecularWeight: 404.50156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)N.CC(C(=O)NCC(=O)O)SC(=O)C1=CC=CS1

Isomeric SMILES

CCCCC(C(=O)O)N.CC(C(=O)NCC(=O)O)SC(=O)C1=CC=CS1

InChI

InChI=1S/C10H11NO4S2.C6H13NO2/c1-6(9(14)11-5-8(12)13)17-10(15)7-3-2-4-16-7;1-2-3-4-5(7)6(8)9/h2-4,6H,5H2,1H3,(H,11,14)(H,12,13);5H,2-4,7H2,1H3,(H,8,9)