(2S)-2-(2-tert-butylsulfanylethanoylamino)-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(2-tert-butylsulfanylethanoylamino)-2-phenyl-ethanoate Openeye Name: (2S)-2-[(2-tert-butylsulfanylacetyl)amino]-2-phenyl-acetate CAS Name: (2S)-2-[[2-(tert-butylthio)-1-oxoethyl]amino]-2-phenylacetate IUPAC Name: (2S)-2-[(2-tert-butylsulfanylacetyl)amino]-2-phenylacetate Traditional Name: (2S)-2-[[2-(tert-butylthio)acetyl]amino]-2-phenyl-acetate Formula: C14H18NO3S- MolecularWeight: 280.36262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)NC(C1=CC=CC=C1)C(=O)[O-]

Isomeric SMILES

CC(C)(C)SCC(=O)N[C@@H](C1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C14H19NO3S/c1-14(2,3)19-9-11(16)15-12(13(17)18)10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3,(H,15,16)(H,17,18)/p-1/t12-/m0/s1