methyl 6-[(2-methylsulfanylphenyl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(2-methylsulfanylphenyl)carbonylamino]hexanoate Openeye Name: methyl 6-[(2-methylsulfanylbenzoyl)amino]hexanoate CAS Name: 6-[[[2-(methylthio)phenyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-methylsulfanylbenzoyl)amino]hexanoate Traditional Name: 6-[[2-(methylthio)benzoyl]amino]hexanoic acid methyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=CC=CC=C1SC

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=CC=CC=C1SC

InChI

InChI=1S/C15H21NO3S/c1-19-14(17)10-4-3-7-11-16-15(18)12-8-5-6-9-13(12)20-2/h5-6,8-9H,3-4,7,10-11H2,1-2H3,(H,16,18)