(2-oxidanylidene-2-thiophen-2-yl-ethyl) (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC=CS1)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)C1=CC=CS1)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H21NO4S/c1-13(2)18(20-17(22)11-14-7-4-3-5-8-14)19(23)24-12-15(21)16-9-6-10-25-16/h3-10,13,18H,11-12H2,1-2H3,(H,20,22)/t18-/m0/s1