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

Systemtic Name: (2S)-N-(2-morpholin-4-ylethyl)-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(2-morpholinoethyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-anilino-2-pyrimidinyl)-N-[2-(4-morpholinyl)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(2-morpholin-4-ylethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-(2-morpholinoethyl)pyrrolidine-2-carboxamide Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NCCN4CCOCC4

Isomeric SMILES

C1C[C@H](N(C1)C2=NC=CC(=N2)NC3=CC=CC=C3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C21H28N6O2/c28-20(22-10-12-26-13-15-29-16-14-26)18-7-4-11-27(18)21-23-9-8-19(25-21)24-17-5-2-1-3-6-17/h1-3,5-6,8-9,18H,4,7,10-16H2,(H,22,28)(H,23,24,25)/t18-/m0/s1