methyl (2S)-3-oxidanyl-2-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[[4-(thiophene-2-carbonylamino)benzoyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[oxo-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[[4-(thiophene-2-carbonylamino)benzoyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[4-(2-thenoylamino)benzoyl]amino]propionic acid methyl ester Formula: C16H16N2O5S MolecularWeight: 348.37364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H16N2O5S/c1-23-16(22)12(9-19)18-14(20)10-4-6-11(7-5-10)17-15(21)13-3-2-8-24-13/h2-8,12,19H,9H2,1H3,(H,17,21)(H,18,20)/t12-/m0/s1