(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4S)-4-oxidanylpent-1-ynyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4S)-4-oxidanylpent-1-ynyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-(tert-butoxycarbonylamino)-3-[(4S)-4-hydroxypent-1-ynyl]sulfanyl-propanoic acid CAS Name: (2R)-3-[[(4S)-4-hydroxypent-1-ynyl]thio]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2R)-3-[(4S)-4-hydroxypent-1-ynyl]sulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-[[(4S)-4-hydroxypent-1-ynyl]thio]propionic acid Formula: C13H21NO5S MolecularWeight: 303.37454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC#CSCC(C(=O)O)NC(=O)OC(C)(C)C)O

Isomeric SMILES

C[C@@H](CC#CSC[C@@H](C(=O)O)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C13H21NO5S/c1-9(15)6-5-7-20-8-10(11(16)17)14-12(18)19-13(2,3)4/h9-10,15H,6,8H2,1-4H3,(H,14,18)(H,16,17)/t9-,10-/m0/s1