3-[2,2-bis(fluoranyl)ethyl]-6-fluoranyl-4-pentyl-4-phenyl-1H-quinazolin-2-one

Systemtic Name: 3-[2,2-bis(fluoranyl)ethyl]-6-fluoranyl-4-pentyl-4-phenyl-1H-quinazolin-2-one Openeye Name: 3-(2,2-difluoroethyl)-6-fluoro-4-pentyl-4-phenyl-1H-quinazolin-2-one CAS Name: 3-(2,2-difluoroethyl)-6-fluoro-4-pentyl-4-phenyl-1H-quinazolin-2-one IUPAC Name: 3-(2,2-difluoroethyl)-6-fluoro-4-pentyl-4-phenyl-1H-quinazolin-2-one Traditional Name: 4-amyl-3-(2,2-difluoroethyl)-6-fluoro-4-phenyl-1H-quinazolin-2-one Formula: C21H23F3N2O MolecularWeight: 376.41533

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C2=C(C=CC(=C2)F)NC(=O)N1CC(F)F)C3=CC=CC=C3

Isomeric SMILES

CCCCCC1(C2=C(C=CC(=C2)F)NC(=O)N1CC(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H23F3N2O/c1-2-3-7-12-21(15-8-5-4-6-9-15)17-13-16(22)10-11-18(17)25-20(27)26(21)14-19(23)24/h4-6,8-11,13,19H,2-3,7,12,14H2,1H3,(H,25,27)