(3-methyl-1,2,4-oxadiazol-5-yl)methyl (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl (2S)-2-(p-tolylsulfonylamino)propanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]propanoic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-(tosylamino)propionic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OCC2=NC(=NO2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)OCC2=NC(=NO2)C

InChI

InChI=1S/C14H17N3O5S/c1-9-4-6-12(7-5-9)23(19,20)17-10(2)14(18)21-8-13-15-11(3)16-22-13/h4-7,10,17H,8H2,1-3H3/t10-/m0/s1