(2S)-3-phenyl-2-(pyrimidin-2-ylamino)propanoate

Systemtic Name: (2S)-3-phenyl-2-(pyrimidin-2-ylamino)propanoate Openeye Name: (2S)-3-phenyl-2-(pyrimidin-2-ylamino)propanoate CAS Name: (2S)-3-phenyl-2-(2-pyrimidinylamino)propanoate IUPAC Name: (2S)-3-phenyl-2-(pyrimidin-2-ylamino)propanoate Traditional Name: (2S)-3-phenyl-2-(2-pyrimidylamino)propionate Formula: C13H12N3O2- MolecularWeight: 242.25328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC2=NC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC2=NC=CC=N2

InChI

InChI=1S/C13H13N3O2/c17-12(18)11(9-10-5-2-1-3-6-10)16-13-14-7-4-8-15-13/h1-8,11H,9H2,(H,17,18)(H,14,15,16)/p-1/t11-/m0/s1