4-[4-[[5-[4-[bis(fluoranyl)methoxy]phenyl]pyrimidin-2-yl]amino]phenyl]carbonyl-1-methyl-piperazin-2-one

Systemtic Name: 4-[4-[[5-[4-[bis(fluoranyl)methoxy]phenyl]pyrimidin-2-yl]amino]phenyl]carbonyl-1-methyl-piperazin-2-one Openeye Name: 4-[4-[[5-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl]amino]benzoyl]-1-methyl-piperazin-2-one CAS Name: 4-[[4-[[5-[4-(difluoromethoxy)phenyl]-2-pyrimidinyl]amino]phenyl]-oxomethyl]-1-methyl-2-piperazinone IUPAC Name: 4-[4-[[5-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl]amino]benzoyl]-1-methylpiperazin-2-one Traditional Name: 4-[4-[[5-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl]amino]benzoyl]-1-methyl-piperazin-2-one Formula: C23H21F2N5O3 MolecularWeight: 453.441346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1=O)C(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CC=C(C=C4)OC(F)F

Isomeric SMILES

CN1CCN(CC1=O)C(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CC=C(C=C4)OC(F)F

InChI

InChI=1S/C23H21F2N5O3/c1-29-10-11-30(14-20(29)31)21(32)16-2-6-18(7-3-16)28-23-26-12-17(13-27-23)15-4-8-19(9-5-15)33-22(24)25/h2-9,12-13,22H,10-11,14H2,1H3,(H,26,27,28)