methyl 6-(2-phenylsulfanylethanoylamino)hexanoate

Systemtic Name: methyl 6-(2-phenylsulfanylethanoylamino)hexanoate Openeye Name: methyl 6-[(2-phenylsulfanylacetyl)amino]hexanoate CAS Name: 6-[[1-oxo-2-(phenylthio)ethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-phenylsulfanylacetyl)amino]hexanoate Traditional Name: 6-[[2-(phenylthio)acetyl]amino]hexanoic acid methyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CSC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCCCCNC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C15H21NO3S/c1-19-15(18)10-6-3-7-11-16-14(17)12-20-13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,16,17)