methyl 6-[[2-(thiophen-3-ylmethylsulfanyl)phenyl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[2-(thiophen-3-ylmethylsulfanyl)phenyl]carbonylamino]hexanoate Openeye Name: methyl 6-[[2-(3-thienylmethylsulfanyl)benzoyl]amino]hexanoate CAS Name: 6-[[oxo-[2-(3-thiophenylmethylthio)phenyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-(thiophen-3-ylmethylsulfanyl)benzoyl]amino]hexanoate Traditional Name: 6-[[2-(3-thenylthio)benzoyl]amino]hexanoic acid methyl ester Formula: C19H23NO3S2 MolecularWeight: 377.52082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=CC=CC=C1SCC2=CSC=C2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=CC=CC=C1SCC2=CSC=C2

InChI

InChI=1S/C19H23NO3S2/c1-23-18(21)9-3-2-6-11-20-19(22)16-7-4-5-8-17(16)25-14-15-10-12-24-13-15/h4-5,7-8,10,12-13H,2-3,6,9,11,14H2,1H3,(H,20,22)