(2S)-1-[2-[2-(pyrimidin-2-ylamino)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[2-[2-(pyrimidin-2-ylamino)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[2-[2-(pyrimidin-2-ylamino)ethylamino]acetyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[1-oxo-2-[2-(2-pyrimidinylamino)ethylamino]ethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[2-[2-(pyrimidin-2-ylamino)ethylamino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[2-[2-(2-pyrimidylamino)ethylamino]acetyl]pyrrolidine-2-carbonitrile Formula: C13H18N6O MolecularWeight: 274.32162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNCCNC2=NC=CC=N2)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CNCCNC2=NC=CC=N2)C#N

InChI

InChI=1S/C13H18N6O/c14-9-11-3-1-8-19(11)12(20)10-15-6-7-18-13-16-4-2-5-17-13/h2,4-5,11,15H,1,3,6-8,10H2,(H,16,17,18)/t11-/m0/s1