N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide CAS Name: N-[4-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]phenyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[4-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide Formula: C23H22F3N5O MolecularWeight: 441.44889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)N4CCCC4

InChI

InChI=1S/C23H22F3N5O/c1-15-13-20(31-11-2-3-12-31)30-22(27-15)29-19-9-7-18(8-10-19)28-21(32)16-5-4-6-17(14-16)23(24,25)26/h4-10,13-14H,2-3,11-12H2,1H3,(H,28,32)(H,27,29,30)