(2S)-2-azanyl-6-[(4-methylsulfanylphenyl)methoxycarbonylamino]hexanoic acid

Systemtic Name: (2S)-2-azanyl-6-[(4-methylsulfanylphenyl)methoxycarbonylamino]hexanoic acid Openeye Name: (2S)-2-amino-6-[(4-methylsulfanylphenyl)methoxycarbonylamino]hexanoic acid CAS Name: (2S)-2-amino-6-[[[4-(methylthio)phenyl]methoxy-oxomethyl]amino]hexanoic acid IUPAC Name: (2S)-2-amino-6-[(4-methylsulfanylphenyl)methoxycarbonylamino]hexanoic acid Traditional Name: (2S)-2-amino-6-[[4-(methylthio)benzyl]oxycarbonylamino]hexanoic acid Formula: C15H22N2O4S MolecularWeight: 326.41118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)NCCCCC(C(=O)O)N

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)NCCCC[C@@H](C(=O)O)N

InChI

InChI=1S/C15H22N2O4S/c1-22-12-7-5-11(6-8-12)10-21-15(20)17-9-3-2-4-13(16)14(18)19/h5-8,13H,2-4,9-10,16H2,1H3,(H,17,20)(H,18,19)/t13-/m0/s1