N,N'-bis[7-(trifluoromethyl)quinazolin-4-yl]nonane-1,9-diamine

Systemtic Name: N,N'-bis[7-(trifluoromethyl)quinazolin-4-yl]nonane-1,9-diamine Openeye Name: N,N'-bis[7-(trifluoromethyl)quinazolin-4-yl]nonane-1,9-diamine CAS Name: N,N'-bis[7-(trifluoromethyl)-4-quinazolinyl]nonane-1,9-diamine IUPAC Name: N,N'-bis[7-(trifluoromethyl)quinazolin-4-yl]nonane-1,9-diamine Traditional Name: [7-(trifluoromethyl)quinazolin-4-yl]-[9-[[7-(trifluoromethyl)quinazolin-4-yl]amino]nonyl]amine Formula: C27H28F6N6 MolecularWeight: 550.541839

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N=CN=C2NCCCCCCCCCNC3=NC=NC4=C3C=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N=CN=C2NCCCCCCCCCNC3=NC=NC4=C3C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C27H28F6N6/c28-26(29,30)18-8-10-20-22(14-18)36-16-38-24(20)34-12-6-4-2-1-3-5-7-13-35-25-21-11-9-19(27(31,32)33)15-23(21)37-17-39-25/h8-11,14-17H,1-7,12-13H2,(H,34,36,38)(H,35,37,39)