2-[3,4-bis(fluoranyl)phenyl]-N-propan-2-yl-4-(2-pyridin-2-ylethylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-N-propan-2-yl-4-(2-pyridin-2-ylethylamino)pyrimidine-5-carboxamide Openeye Name: 2-(3,4-difluorophenyl)-N-isopropyl-4-[2-(2-pyridyl)ethylamino]pyrimidine-5-carboxamide CAS Name: 2-(3,4-difluorophenyl)-N-propan-2-yl-4-[2-(2-pyridinyl)ethylamino]-5-pyrimidinecarboxamide IUPAC Name: 2-(3,4-difluorophenyl)-N-propan-2-yl-4-(2-pyridin-2-ylethylamino)pyrimidine-5-carboxamide Traditional Name: 2-(3,4-difluorophenyl)-N-isopropyl-4-[2-(2-pyridyl)ethylamino]pyrimidine-5-carboxamide Formula: C21H21F2N5O MolecularWeight: 397.421146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN=C(N=C1NCCC2=CC=CC=N2)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CC(C)NC(=O)C1=CN=C(N=C1NCCC2=CC=CC=N2)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C21H21F2N5O/c1-13(2)27-21(29)16-12-26-19(14-6-7-17(22)18(23)11-14)28-20(16)25-10-8-15-5-3-4-9-24-15/h3-7,9,11-13H,8,10H2,1-2H3,(H,27,29)(H,25,26,28)