1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]-N-(3-morpholin-4-ylpropyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[6-[(3-bromophenyl)amino]pyrimidin-4-yl]-N-(3-morpholin-4-ylpropyl)pyrrolidine-2-carboxamide Openeye Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide CAS Name: 1-[6-(3-bromoanilino)-4-pyrimidinyl]-N-[3-(4-morpholinyl)propyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-(3-morpholin-4-ylpropyl)pyrrolidine-2-carboxamide Traditional Name: 1-[6-(3-bromoanilino)pyrimidin-4-yl]-N-(3-morpholinopropyl)pyrrolidine-2-carboxamide Formula: C22H29BrN6O2 MolecularWeight: 489.40866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29BrN6O2/c23-17-4-1-5-18(14-17)27-20-15-21(26-16-25-20)29-9-2-6-19(29)22(30)24-7-3-8-28-10-12-31-13-11-28/h1,4-5,14-16,19H,2-3,6-13H2,(H,24,30)(H,25,26,27)