[1-[2-[6-(methoxycarbonylamino)hexylcarbamoyloxy]ethylamino]-1-oxidanylidene-propan-2-yl] ethanedithioate

Systemtic Name: [1-[2-[6-(methoxycarbonylamino)hexylcarbamoyloxy]ethylamino]-1-oxidanylidene-propan-2-yl] ethanedithioate Openeye Name: [2-[2-[6-(methoxycarbonylamino)hexylcarbamoyloxy]ethylamino]-1-methyl-2-oxo-ethyl] ethanedithioate CAS Name: ethanedithioic acid [1-[2-[[6-(methoxycarbonylamino)hexylamino]-oxomethoxy]ethylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[2-[6-(methoxycarbonylamino)hexylcarbamoyloxy]ethylamino]-1-oxopropan-2-yl] ethanedithioate Traditional Name: ethanedithioic acid [2-[2-[6-(carbomethoxyamino)hexylcarbamoyloxy]ethylamino]-2-keto-1-methyl-ethyl] ester Formula: C16H29N3O5S2 MolecularWeight: 407.54856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC(=O)NCCCCCCNC(=O)OC)SC(=S)C

Isomeric SMILES

CC(C(=O)NCCOC(=O)NCCCCCCNC(=O)OC)SC(=S)C

InChI

InChI=1S/C16H29N3O5S2/c1-12(26-13(2)25)14(20)17-10-11-24-16(22)19-9-7-5-4-6-8-18-15(21)23-3/h12H,4-11H2,1-3H3,(H,17,20)(H,18,21)(H,19,22)