(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) (2S)-3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: (2S)-3-methyl-2-(tosylamino)butyric acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC(C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)OC(C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C20H24N2O5S/c1-13(2)17(22-28(25,26)16-11-9-14(3)10-12-16)20(24)27-18(19(21)23)15-7-5-4-6-8-15/h4-13,17-18,22H,1-3H3,(H2,21,23)/t17-,18?/m0/s1