methyl 6-[2-(cyanomethylsulfanyl)ethanoylamino]hexanoate

Systemtic Name: methyl 6-[2-(cyanomethylsulfanyl)ethanoylamino]hexanoate Openeye Name: methyl 6-[[2-(cyanomethylsulfanyl)acetyl]amino]hexanoate CAS Name: 6-[[2-(cyanomethylthio)-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-(cyanomethylsulfanyl)acetyl]amino]hexanoate Traditional Name: 6-[[2-(cyanomethylthio)acetyl]amino]hexanoic acid methyl ester Formula: C11H18N2O3S MolecularWeight: 258.33722

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CSCC#N

Isomeric SMILES

COC(=O)CCCCCNC(=O)CSCC#N

InChI

InChI=1S/C11H18N2O3S/c1-16-11(15)5-3-2-4-7-13-10(14)9-17-8-6-12/h2-5,7-9H2,1H3,(H,13,14)