methyl 3-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]amino]-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-keto-ethyl]thio]propionic acid methyl ester Formula: C15H24N2O4S MolecularWeight: 328.42706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NC(=O)NCCC1=CCCCC1

Isomeric SMILES

COC(=O)CCSCC(=O)NC(=O)NCCC1=CCCCC1

InChI

InChI=1S/C15H24N2O4S/c1-21-14(19)8-10-22-11-13(18)17-15(20)16-9-7-12-5-3-2-4-6-12/h5H,2-4,6-11H2,1H3,(H2,16,17,18,20)