methyl (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]butanoate

Systemtic Name: methyl (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]butanoate Openeye Name: methyl (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-carbonyl]amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo-[5-(phenoxymethyl)-2-furanyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfanyl-2-[[5-(phenoxymethyl)furan-2-carbonyl]amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[[5-(phenoxymethyl)-2-furoyl]amino]butyric acid methyl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC=C(O1)COC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5S/c1-22-18(21)15(10-11-25-2)19-17(20)16-9-8-14(24-16)12-23-13-6-4-3-5-7-13/h3-9,15H,10-12H2,1-2H3,(H,19,20)/t15-/m0/s1