methyl 6-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]hexanoate

Systemtic Name: methyl 6-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]hexanoate Openeye Name: methyl 6-[[2-(2-thienylmethylsulfanyl)acetyl]amino]hexanoate CAS Name: 6-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]hexanoate Traditional Name: 6-[[2-(2-thenylthio)acetyl]amino]hexanoic acid methyl ester Formula: C14H21NO3S2 MolecularWeight: 315.45144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CSCC1=CC=CS1

Isomeric SMILES

COC(=O)CCCCCNC(=O)CSCC1=CC=CS1

InChI

InChI=1S/C14H21NO3S2/c1-18-14(17)7-3-2-4-8-15-13(16)11-19-10-12-6-5-9-20-12/h5-6,9H,2-4,7-8,10-11H2,1H3,(H,15,16)