(2S)-2-[2-(4-ethylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-[2-(4-ethylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-[[2-(4-ethylphenoxy)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[2-(4-ethylphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-[[2-(4-ethylphenoxy)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-[[2-(4-ethylphenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)N[C@@H](CCSC)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-3-11-4-6-12(7-5-11)20-10-14(17)16-13(15(18)19)8-9-21-2/h4-7,13H,3,8-10H2,1-2H3,(H,16,17)(H,18,19)/t13-/m0/s1