methyl (2S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: methyl (2S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: methyl (2S)-3-(tert-butoxycarbonylamino)-2-(2-thienylsulfonylamino)propanoate CAS Name: (2S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(thiophen-2-ylsulfonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: (2S)-3-(tert-butoxycarbonylamino)-2-(2-thienylsulfonylamino)propionic acid methyl ester Formula: C13H20N2O6S2 MolecularWeight: 364.4377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(C(=O)OC)NS(=O)(=O)C1=CC=CS1

Isomeric SMILES

CC(C)(C)OC(=O)NC[C@@H](C(=O)OC)NS(=O)(=O)C1=CC=CS1

InChI

InChI=1S/C13H20N2O6S2/c1-13(2,3)21-12(17)14-8-9(11(16)20-4)15-23(18,19)10-6-5-7-22-10/h5-7,9,15H,8H2,1-4H3,(H,14,17)/t9-/m0/s1