[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-thiophen-2-yl-ethyl] methanesulfonate

Systemtic Name: [(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-thiophen-2-yl-ethyl] methanesulfonate Openeye Name: [(2S)-2-(tert-butoxycarbonylamino)-2-(2-thienyl)ethyl] methanesulfonate CAS Name: methanesulfonic acid [(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophen-2-ylethyl] ester IUPAC Name: [(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-thiophen-2-ylethyl] methanesulfonate Traditional Name: methanesulfonic acid [(2S)-2-(tert-butoxycarbonylamino)-2-(2-thienyl)ethyl] ester Formula: C12H19NO5S2 MolecularWeight: 321.41296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COS(=O)(=O)C)C1=CC=CS1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](COS(=O)(=O)C)C1=CC=CS1

InChI

InChI=1S/C12H19NO5S2/c1-12(2,3)18-11(14)13-9(8-17-20(4,15)16)10-6-5-7-19-10/h5-7,9H,8H2,1-4H3,(H,13,14)/t9-/m0/s1