methyl 4-methylsulfanyl-2-(3-morpholin-4-ylpropylcarbamoylamino)butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-(3-morpholin-4-ylpropylcarbamoylamino)butanoate Openeye Name: methyl 4-methylsulfanyl-2-(3-morpholinopropylcarbamoylamino)butanoate CAS Name: 4-(methylthio)-2-[[[3-(4-morpholinyl)propylamino]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-2-(3-morpholin-4-ylpropylcarbamoylamino)butanoate Traditional Name: 4-(methylthio)-2-(3-morpholinopropylcarbamoylamino)butyric acid methyl ester Formula: C14H27N3O4S MolecularWeight: 333.44688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)NCCCN1CCOCC1

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)NCCCN1CCOCC1

InChI

InChI=1S/C14H27N3O4S/c1-20-13(18)12(4-11-22-2)16-14(19)15-5-3-6-17-7-9-21-10-8-17/h12H,3-11H2,1-2H3,(H2,15,16,19)