methyl 6-(3-phenylsulfanylpropanoylamino)hexanoate

Systemtic Name: methyl 6-(3-phenylsulfanylpropanoylamino)hexanoate Openeye Name: methyl 6-(3-phenylsulfanylpropanoylamino)hexanoate CAS Name: 6-[[1-oxo-3-(phenylthio)propyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-(3-phenylsulfanylpropanoylamino)hexanoate Traditional Name: 6-[3-(phenylthio)propanoylamino]hexanoic acid methyl ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CCSC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCCCCNC(=O)CCSC1=CC=CC=C1

InChI

InChI=1S/C16H23NO3S/c1-20-16(19)10-6-3-7-12-17-15(18)11-13-21-14-8-4-2-5-9-14/h2,4-5,8-9H,3,6-7,10-13H2,1H3,(H,17,18)