2,2,2-tris(fluoranyl)-N-[(6-phenyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-[(6-phenyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]ethanamide Openeye Name: 2,2,2-trifluoro-N-[(6-phenyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]acetamide CAS Name: 2,2,2-trifluoro-N-[(6-phenyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]acetamide IUPAC Name: 2,2,2-trifluoro-N-[(6-phenyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]acetamide Traditional Name: 2,2,2-trifluoro-N-[(6-phenyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]acetamide Formula: C18H12F3N5O MolecularWeight: 371.31599

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)CNC(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)CNC(=O)C(F)(F)F

InChI

InChI=1S/C18H12F3N5O/c19-18(20,21)17(27)22-10-14-23-24-16-13-9-5-4-8-12(13)15(25-26(14)16)11-6-2-1-3-7-11/h1-9H,10H2,(H,22,27)