S-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-sulfanyl-hexyl] ethanethioate

Systemtic Name: S-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-sulfanyl-hexyl] ethanethioate Openeye Name: S-[(3S)-3-(tert-butoxycarbonylamino)-6-sulfanyl-hexyl] ethanethioate CAS Name: ethanethioic acid S-[(3S)-6-mercapto-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexyl] ester IUPAC Name: S-[(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-6-sulfanylhexyl] ethanethioate Traditional Name: ethanethioic acid S-[(3S)-3-(tert-butoxycarbonylamino)-6-mercapto-hexyl] ester Formula: C13H25NO3S2 MolecularWeight: 307.4725

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(CCCS)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCC[C@H](CCCS)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H25NO3S2/c1-10(15)19-9-7-11(6-5-8-18)14-12(16)17-13(2,3)4/h11,18H,5-9H2,1-4H3,(H,14,16)/t11-/m0/s1