4-[[4-azanyl-6-[[3-(trifluoromethyloxy)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-[[3-(trifluoromethyloxy)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-[[3-(trifluoromethoxy)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-[[3-(trifluoromethoxy)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-[[3-(trifluoromethoxy)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-[3-(trifluoromethoxy)benzyl]-s-triazin-2-yl]amino]benzonitrile Formula: C18H13F3N6O MolecularWeight: 386.33063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)CC2=NC(=NC(=N2)NC3=CC=C(C=C3)C#N)N

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)CC2=NC(=NC(=N2)NC3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C18H13F3N6O/c19-18(20,21)28-14-3-1-2-12(8-14)9-15-25-16(23)27-17(26-15)24-13-6-4-11(10-22)5-7-13/h1-8H,9H2,(H3,23,24,25,26,27)