azepan-1-yl-[5-phenyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone

Systemtic Name: azepan-1-yl-[5-phenyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone Openeye Name: azepan-1-yl-[5-phenyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone CAS Name: 1-azepanyl-[5-phenyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone IUPAC Name: azepan-1-yl-[5-phenyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone Traditional Name: azepan-1-yl-[5-phenyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone Formula: C19H18F3N5O MolecularWeight: 389.37433

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=NN3C(=CC(=NC3=N2)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=NN3C(=CC(=NC3=N2)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C19H18F3N5O/c20-19(21,22)15-12-14(13-8-4-3-5-9-13)23-18-24-16(25-27(15)18)17(28)26-10-6-1-2-7-11-26/h3-5,8-9,12H,1-2,6-7,10-11H2