methyl 2-[5-(1,2-dithiolan-3-yl)pentylcarbamoylamino]ethanoate

Systemtic Name: methyl 2-[5-(1,2-dithiolan-3-yl)pentylcarbamoylamino]ethanoate Openeye Name: methyl 2-[5-(dithiolan-3-yl)pentylcarbamoylamino]acetate CAS Name: 2-[[[5-(3-dithiolanyl)pentylamino]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[5-(dithiolan-3-yl)pentylcarbamoylamino]acetate Traditional Name: 2-[5-(dithiolan-3-yl)pentylcarbamoylamino]acetic acid methyl ester Formula: C12H22N2O3S2 MolecularWeight: 306.44468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)NCCCCCC1CCSS1

Isomeric SMILES

COC(=O)CNC(=O)NCCCCCC1CCSS1

InChI

InChI=1S/C12H22N2O3S2/c1-17-11(15)9-14-12(16)13-7-4-2-3-5-10-6-8-18-19-10/h10H,2-9H2,1H3,(H2,13,14,16)