2-(2-tert-butylsulfanylethanoylamino)hexanoic acid

Systemtic Name: 2-(2-tert-butylsulfanylethanoylamino)hexanoic acid Openeye Name: 2-[(2-tert-butylsulfanylacetyl)amino]hexanoic acid CAS Name: 2-[[2-(tert-butylthio)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 2-[(2-tert-butylsulfanylacetyl)amino]hexanoic acid Traditional Name: 2-[[2-(tert-butylthio)acetyl]amino]hexanoic acid Formula: C12H23NO3S MolecularWeight: 261.38092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO3S/c1-5-6-7-9(11(15)16)13-10(14)8-17-12(2,3)4/h9H,5-8H2,1-4H3,(H,13,14)(H,15,16)