3-[1-[4-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylpyridin-2-yl]piperidin-4-yl]-8-fluoranyl-1,4-dihydroquinazolin-2-one

Systemtic Name: 3-[1-[4-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylpyridin-2-yl]piperidin-4-yl]-8-fluoranyl-1,4-dihydroquinazolin-2-one Openeye Name: 8-fluoro-3-[1-[4-(4-hydroxy-3,5-dimethyl-benzoyl)-2-pyridyl]-4-piperidyl]-1,4-dihydroquinazolin-2-one CAS Name: 8-fluoro-3-[1-[4-[(4-hydroxy-3,5-dimethylphenyl)-oxomethyl]-2-pyridinyl]-4-piperidinyl]-1,4-dihydroquinazolin-2-one IUPAC Name: 8-fluoro-3-[1-[4-(4-hydroxy-3,5-dimethylbenzoyl)pyridin-2-yl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one Traditional Name: 8-fluoro-3-[1-[4-(4-hydroxy-3,5-dimethyl-benzoyl)-2-pyridyl]-4-piperidyl]-1,4-dihydroquinazolin-2-one Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(=O)C2=CC(=NC=C2)N3CCC(CC3)N4CC5=C(C(=CC=C5)F)NC4=O

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(=O)C2=CC(=NC=C2)N3CCC(CC3)N4CC5=C(C(=CC=C5)F)NC4=O

InChI

InChI=1S/C27H27FN4O3/c1-16-12-20(13-17(2)25(16)33)26(34)18-6-9-29-23(14-18)31-10-7-21(8-11-31)32-15-19-4-3-5-22(28)24(19)30-27(32)35/h3-6,9,12-14,21,33H,7-8,10-11,15H2,1-2H3,(H,30,35)