5-[2-(2-azanylpyrimidin-5-yl)ethynyl]-2-methoxy-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 5-[2-(2-azanylpyrimidin-5-yl)ethynyl]-2-methoxy-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-2-methoxy-N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 5-[2-(2-amino-5-pyrimidinyl)ethynyl]-2-methoxy-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-2-methoxy-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-2-methoxy-N-[2-piperidino-5-(trifluoromethyl)phenyl]benzamide Formula: C26H24F3N5O2 MolecularWeight: 495.49627

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C#CC2=CN=C(N=C2)N)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C#CC2=CN=C(N=C2)N)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

InChI

InChI=1S/C26H24F3N5O2/c1-36-23-10-7-17(5-6-18-15-31-25(30)32-16-18)13-20(23)24(35)33-21-14-19(26(27,28)29)8-9-22(21)34-11-3-2-4-12-34/h7-10,13-16H,2-4,11-12H2,1H3,(H,33,35)(H2,30,31,32)