methyl 4-methylsulfanyl-2-(2-morpholin-4-ylethylcarbamoylamino)butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-(2-morpholin-4-ylethylcarbamoylamino)butanoate Openeye Name: methyl 4-methylsulfanyl-2-(2-morpholinoethylcarbamoylamino)butanoate CAS Name: 4-(methylthio)-2-[[[2-(4-morpholinyl)ethylamino]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-(2-morpholin-4-ylethylcarbamoylamino)butanoate Traditional Name: 4-(methylthio)-2-(2-morpholinoethylcarbamoylamino)butyric acid methyl ester Formula: C13H25N3O4S MolecularWeight: 319.4203

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)NCCN1CCOCC1

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)NCCN1CCOCC1

InChI

InChI=1S/C13H25N3O4S/c1-19-12(17)11(3-10-21-2)15-13(18)14-4-5-16-6-8-20-9-7-16/h11H,3-10H2,1-2H3,(H2,14,15,18)