N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-3-morpholin-4-yl-5-(trifluoromethyl)benzamide

Systemtic Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-3-morpholin-4-yl-5-(trifluoromethyl)benzamide Openeye Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-3-morpholino-5-(trifluoromethyl)benzamide CAS Name: N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-3-(4-morpholinyl)-5-(trifluoromethyl)benzamide IUPAC Name: N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-3-morpholin-4-yl-5-(trifluoromethyl)benzamide Traditional Name: N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-3-morpholino-5-(trifluoromethyl)benzamide Formula: C28H25F3N6O2 MolecularWeight: 534.53231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)N3CCOCC3)C(F)(F)F)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)N3CCOCC3)C(F)(F)F)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C28H25F3N6O2/c1-18-4-5-22(16-25(18)36-27-33-8-6-24(35-27)19-3-2-7-32-17-19)34-26(38)20-13-21(28(29,30)31)15-23(14-20)37-9-11-39-12-10-37/h2-8,13-17H,9-12H2,1H3,(H,34,38)(H,33,35,36)