N1-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-N4-(7H-purin-6-yl)cyclohexane-1,4-diamine

Systemtic Name: N1-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-N4-(7H-purin-6-yl)cyclohexane-1,4-diamine Openeye Name: N1-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-N4-(7H-purin-6-yl)cyclohexane-1,4-diamine CAS Name: N1-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-N4-(7H-purin-6-yl)cyclohexane-1,4-diamine IUPAC Name: 1-N-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-4-N-(7H-purin-6-yl)cyclohexane-1,4-diamine Traditional Name: [8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-[4-(7H-purin-6-ylamino)cyclohexyl]amine Formula: C26H23F3N8 MolecularWeight: 504.50963

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CC=CC=C4)NC5=NC=NC6=C5NC=N6

Isomeric SMILES

C1CC(CCC1NC2=NC=C(C3=C2C=CC(=N3)C(F)(F)F)C4=CC=CC=C4)NC5=NC=NC6=C5NC=N6

InChI

InChI=1S/C26H23F3N8/c27-26(28,29)20-11-10-18-21(37-20)19(15-4-2-1-3-5-15)12-30-23(18)35-16-6-8-17(9-7-16)36-25-22-24(32-13-31-22)33-14-34-25/h1-5,10-14,16-17H,6-9H2,(H,30,35)(H2,31,32,33,34,36)