4-methylsulfanyl-2-(3-morpholin-4-ylpropylcarbamoylamino)butanoic acid

Systemtic Name: 4-methylsulfanyl-2-(3-morpholin-4-ylpropylcarbamoylamino)butanoic acid Openeye Name: 4-methylsulfanyl-2-(3-morpholinopropylcarbamoylamino)butanoic acid CAS Name: 4-(methylthio)-2-[[[3-(4-morpholinyl)propylamino]-oxomethyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-(3-morpholin-4-ylpropylcarbamoylamino)butanoic acid Traditional Name: 4-(methylthio)-2-(3-morpholinopropylcarbamoylamino)butyric acid Formula: C13H25N3O4S MolecularWeight: 319.4203

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)NCCCN1CCOCC1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)NCCCN1CCOCC1

InChI

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