5-bromanyl-N4-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]-N2-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N4-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]-N2-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-N2-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-N2-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]pyrimidine-2,4-diamine Traditional Name: [5-bromo-4-[[3-fluoro-5-(trifluoromethyl)benzyl]amino]pyrimidin-2-yl]-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]amine Formula: C25H21BrF4N6 MolecularWeight: 561.372053

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC=C1C2=CNC3=C2C=C(C=C3)NC4=NC=C(C(=N4)NCC5=CC(=CC(=C5)F)C(F)(F)F)Br

Isomeric SMILES

C1CNCC=C1C2=CNC3=C2C=C(C=C3)NC4=NC=C(C(=N4)NCC5=CC(=CC(=C5)F)C(F)(F)F)Br

InChI

InChI=1S/C25H21BrF4N6/c26-21-13-34-24(36-23(21)33-11-14-7-16(25(28,29)30)9-17(27)8-14)35-18-1-2-22-19(10-18)20(12-32-22)15-3-5-31-6-4-15/h1-3,7-10,12-13,31-32H,4-6,11H2,(H2,33,34,35,36)