N-(4-propylphenyl)-4-[[4-[2,2,2-tris(fluoranyl)ethylamino]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide

Systemtic Name: N-(4-propylphenyl)-4-[[4-[2,2,2-tris(fluoranyl)ethylamino]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide Openeye Name: N-(4-propylphenyl)-4-[[4-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide CAS Name: N-(4-propylphenyl)-4-[[4-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide IUPAC Name: N-(4-propylphenyl)-4-[[4-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide Traditional Name: N-(4-propylphenyl)-4-[[4-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide Formula: C24H23F3N6O MolecularWeight: 468.47423

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC3=NC4=C(C=CN4)C(=N3)NCC(F)(F)F

Isomeric SMILES

CCCC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC3=NC4=C(C=CN4)C(=N3)NCC(F)(F)F

InChI

InChI=1S/C24H23F3N6O/c1-2-3-15-4-8-17(9-5-15)30-22(34)16-6-10-18(11-7-16)31-23-32-20-19(12-13-28-20)21(33-23)29-14-24(25,26)27/h4-13H,2-3,14H2,1H3,(H,30,34)(H3,28,29,31,32,33)