methyl 4-[4-(1,2-dithiolan-3-yl)butylcarbamoylamino]butanoate

Systemtic Name: methyl 4-[4-(1,2-dithiolan-3-yl)butylcarbamoylamino]butanoate Openeye Name: methyl 4-[4-(dithiolan-3-yl)butylcarbamoylamino]butanoate CAS Name: 4-[[[4-(3-dithiolanyl)butylamino]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(dithiolan-3-yl)butylcarbamoylamino]butanoate Traditional Name: 4-[4-(dithiolan-3-yl)butylcarbamoylamino]butyric acid methyl ester Formula: C13H24N2O3S2 MolecularWeight: 320.47126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)NCCCCC1CCSS1

Isomeric SMILES

COC(=O)CCCNC(=O)NCCCCC1CCSS1

InChI

InChI=1S/C13H24N2O3S2/c1-18-12(16)6-4-9-15-13(17)14-8-3-2-5-11-7-10-19-20-11/h11H,2-10H2,1H3,(H2,14,15,17)