methyl 2-(cyclohexylcarbamoylamino)-3-(methylsulfanylmethylsulfanyl)propanoate

Systemtic Name: methyl 2-(cyclohexylcarbamoylamino)-3-(methylsulfanylmethylsulfanyl)propanoate Openeye Name: methyl 2-(cyclohexylcarbamoylamino)-3-(methylsulfanylmethylsulfanyl)propanoate CAS Name: 2-[[(cyclohexylamino)-oxomethyl]amino]-3-[(methylthio)methylthio]propanoic acid methyl ester IUPAC Name: methyl 2-(cyclohexylcarbamoylamino)-3-(methylsulfanylmethylsulfanyl)propanoate Traditional Name: 2-(cyclohexylcarbamoylamino)-3-[(methylthio)methylthio]propionic acid methyl ester Formula: C13H24N2O3S2 MolecularWeight: 320.47126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSCSC)NC(=O)NC1CCCCC1

Isomeric SMILES

COC(=O)C(CSCSC)NC(=O)NC1CCCCC1

InChI

InChI=1S/C13H24N2O3S2/c1-18-12(16)11(8-20-9-19-2)15-13(17)14-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3,(H2,14,15,17)