2-(2-propan-2-ylsulfanylethanoylamino)hexanoic acid

Systemtic Name: 2-(2-propan-2-ylsulfanylethanoylamino)hexanoic acid Openeye Name: 2-[(2-isopropylsulfanylacetyl)amino]hexanoic acid CAS Name: 2-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]hexanoic acid IUPAC Name: 2-[(2-propan-2-ylsulfanylacetyl)amino]hexanoic acid Traditional Name: 2-[[2-(isopropylthio)acetyl]amino]hexanoic acid Formula: C11H21NO3S MolecularWeight: 247.35434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)CSC(C)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CSC(C)C

InChI

InChI=1S/C11H21NO3S/c1-4-5-6-9(11(14)15)12-10(13)7-16-8(2)3/h8-9H,4-7H2,1-3H3,(H,12,13)(H,14,15)