methyl (2S)-4-methylsulfanyl-2-[(4-phenoxyphenyl)carbonylamino]butanoate

Systemtic Name: methyl (2S)-4-methylsulfanyl-2-[(4-phenoxyphenyl)carbonylamino]butanoate Openeye Name: methyl (2S)-4-methylsulfanyl-2-[(4-phenoxybenzoyl)amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo-(4-phenoxyphenyl)methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfanyl-2-[(4-phenoxybenzoyl)amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[(4-phenoxybenzoyl)amino]butyric acid methyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C19H21NO4S/c1-23-19(22)17(12-13-25-2)20-18(21)14-8-10-16(11-9-14)24-15-6-4-3-5-7-15/h3-11,17H,12-13H2,1-2H3,(H,20,21)/t17-/m0/s1