(2S)-N-(3-morpholin-4-ylpropyl)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(3-morpholin-4-ylpropyl)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-anilino-2-pyrimidinyl)-N-[3-(4-morpholinyl)propyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(3-morpholin-4-ylpropyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

Isomeric SMILES

C1C[C@H](N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C22H30N6O2/c29-21(23-10-5-12-27-14-16-30-17-15-27)19-8-4-13-28(19)22-24-11-9-20(26-22)25-18-6-2-1-3-7-18/h1-3,6-7,9,11,19H,4-5,8,10,12-17H2,(H,23,29)(H,24,25,26)/t19-/m0/s1