5-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C18H15F6N3O MolecularWeight: 403.321619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=NC(=CC(=O)N2N1)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC2=NC(=CC(=O)N2N1)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H15F6N3O/c1-16(2,3)13-8-14-25-12(7-15(28)27(14)26-13)9-4-10(17(19,20)21)6-11(5-9)18(22,23)24/h4-8,26H,1-3H3