(2S)-1-(4-phenylazanylpyrimidin-2-yl)-N-(2-pyridin-3-ylethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-phenylazanylpyrimidin-2-yl)-N-(2-pyridin-3-ylethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-[2-(3-pyridyl)ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-anilino-2-pyrimidinyl)-N-[2-(3-pyridinyl)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(2-pyridin-3-ylethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-[2-(3-pyridyl)ethyl]pyrrolidine-2-carboxamide Formula: C22H24N6O MolecularWeight: 388.46556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NCCC4=CN=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NCCC4=CN=CC=C4

InChI

InChI=1S/C22H24N6O/c29-21(24-13-10-17-6-4-12-23-16-17)19-9-5-15-28(19)22-25-14-11-20(27-22)26-18-7-2-1-3-8-18/h1-4,6-8,11-12,14,16,19H,5,9-10,13,15H2,(H,24,29)(H,25,26,27)/t19-/m0/s1