7-fluoranyl-3-[2-oxidanyl-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]quinazolin-4-one

Systemtic Name: 7-fluoranyl-3-[2-oxidanyl-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]quinazolin-4-one Openeye Name: 7-fluoro-3-[2-hydroxy-3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propyl]quinazolin-4-one CAS Name: 7-fluoro-3-[2-hydroxy-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]-4-quinazolinone IUPAC Name: 7-fluoro-3-[2-hydroxy-3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propyl]quinazolin-4-one Traditional Name: 7-fluoro-3-[2-hydroxy-3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propyl]quinazolin-4-one Formula: C25H31FN2O3 MolecularWeight: 426.523643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC(CN2C=NC3=C(C2=O)C=CC(=C3)F)O

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC(CN2C=NC3=C(C2=O)C=CC(=C3)F)O

InChI

InChI=1S/C25H31FN2O3/c1-24(2,3)15-25(4,5)17-6-9-20(10-7-17)31-14-19(29)13-28-16-27-22-12-18(26)8-11-21(22)23(28)30/h6-12,16,19,29H,13-15H2,1-5H3