(2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2-phenyl-acetate CAS Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2-phenylacetate IUPAC Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2-phenylacetate Traditional Name: (2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2-phenyl-acetate Formula: C13H14N3O4S- MolecularWeight: 308.33296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N[C@@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c1-8-12(9(2)15-14-8)21(19,20)16-11(13(17)18)10-6-4-3-5-7-10/h3-7,11,16H,1-2H3,(H,14,15)(H,17,18)/p-1/t11-/m0/s1