N-(2-phenylpyrimidin-5-yl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-phenylpyrimidin-5-yl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-phenylpyrimidin-5-yl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide CAS Name: N-(2-phenyl-5-pyrimidinyl)-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxamide IUPAC Name: N-(2-phenylpyrimidin-5-yl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Traditional Name: N-(2-phenylpyrimidin-5-yl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Formula: C20H13F3N6O MolecularWeight: 410.35203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=C(C=N2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=C(C=N2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C20H13F3N6O/c21-20(22,23)15-8-4-5-9-17(15)29-12-16(27-28-29)19(30)26-14-10-24-18(25-11-14)13-6-2-1-3-7-13/h1-12H,(H,26,30)