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methyl 4-methylsulfanyl-2-(octylcarbamoylamino)butanoate

methyl 4-methylsulfanyl-2-(octylcarbamoylamino)butanoate

Systemtic Name:methyl 4-methylsulfanyl-2-(octylcarbamoylamino)butanoate
Openeye Name:methyl 4-methylsulfanyl-2-(octylcarbamoylamino)butanoate
CAS Name:4-(methylthio)-2-[[(octylamino)-oxomethyl]amino]butanoic acid methyl ester
IUPAC Name:methyl 4-methylsulfanyl-2-(octylcarbamoylamino)butanoate
Traditional Name:4-(methylthio)-2-(octylcarbamoylamino)butyric acid methyl ester
Formula: C15H30N2O3S
MolecularWeight: 318.4753
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC(CCSC)C(=O)OC


Isomeric SMILES

CCCCCCCCNC(=O)NC(CCSC)C(=O)OC


InChI

InChI=1S/C15H30N2O3S/c1-4-5-6-7-8-9-11-16-15(19)17-13(10-12-21-3)14(18)20-2/h13H,4-12H2,1-3H3,(H2,16,17,19)


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