1-(1-adamantylmethyl)-4-phenyl-6-(trifluoromethyl)quinazolin-2-one

Systemtic Name: 1-(1-adamantylmethyl)-4-phenyl-6-(trifluoromethyl)quinazolin-2-one Openeye Name: 1-(1-adamantylmethyl)-4-phenyl-6-(trifluoromethyl)quinazolin-2-one CAS Name: 1-(1-adamantylmethyl)-4-phenyl-6-(trifluoromethyl)-2-quinazolinone IUPAC Name: 1-(1-adamantylmethyl)-4-phenyl-6-(trifluoromethyl)quinazolin-2-one Traditional Name: 1-(1-adamantylmethyl)-4-phenyl-6-(trifluoromethyl)quinazolin-2-one Formula: C26H25F3N2O MolecularWeight: 438.48471

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CN4C5=C(C=C(C=C5)C(F)(F)F)C(=NC4=O)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CN4C5=C(C=C(C=C5)C(F)(F)F)C(=NC4=O)C6=CC=CC=C6

InChI

InChI=1S/C26H25F3N2O/c27-26(28,29)20-6-7-22-21(11-20)23(19-4-2-1-3-5-19)30-24(32)31(22)15-25-12-16-8-17(13-25)10-18(9-16)14-25/h1-7,11,16-18H,8-10,12-15H2