[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)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-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C20H24N2O4S MolecularWeight: 388.48056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC1=CC=CS1)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NCC1=CC=CS1)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O4S/c1-14(2)19(22-17(23)11-15-7-4-3-5-8-15)20(25)26-13-18(24)21-12-16-9-6-10-27-16/h3-10,14,19H,11-13H2,1-2H3,(H,21,24)(H,22,23)/t19-/m0/s1