[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoate Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl] 3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propanoate CAS Name: 3-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]propanoic acid [(2S)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl] 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoate Traditional Name: 3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propionic acid [(1S)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NCCC(=O)OC(C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NCCC(=O)O[C@@H](C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H21N3O6S/c1-11-16(12(2)26-20-11)27(23,24)18-10-9-15(21)25-13(3)17(22)19-14-7-5-4-6-8-14/h4-8,13,18H,9-10H2,1-3H3,(H,19,22)/t13-/m0/s1