(2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]butanoic acid

Systemtic Name: (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]butanoic acid Openeye Name: (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-carbonyl]amino]butanoic acid CAS Name: (2S)-4-(methylthio)-2-[[oxo-[5-(phenoxymethyl)-2-furanyl]methyl]amino]butanoic acid IUPAC Name: (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-carbonyl]amino]butanoic acid Traditional Name: (2S)-4-(methylthio)-2-[[5-(phenoxymethyl)-2-furoyl]amino]butyric acid Formula: C17H19NO5S MolecularWeight: 349.40146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC=C(O1)COC2=CC=CC=C2

Isomeric SMILES

CSCC[C@@H](C(=O)O)NC(=O)C1=CC=C(O1)COC2=CC=CC=C2

InChI

InChI=1S/C17H19NO5S/c1-24-10-9-14(17(20)21)18-16(19)15-8-7-13(23-15)11-22-12-5-3-2-4-6-12/h2-8,14H,9-11H2,1H3,(H,18,19)(H,20,21)/t14-/m0/s1