6-fluoranyl-4-phenyl-3-[1-(phenylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one

Systemtic Name: 6-fluoranyl-4-phenyl-3-[1-(phenylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one Openeye Name: 3-(1-benzyl-4-piperidyl)-6-fluoro-4-phenyl-1,4-dihydroquinazolin-2-one CAS Name: 6-fluoro-4-phenyl-3-[1-(phenylmethyl)-4-piperidinyl]-1,4-dihydroquinazolin-2-one IUPAC Name: 3-(1-benzylpiperidin-4-yl)-6-fluoro-4-phenyl-1,4-dihydroquinazolin-2-one Traditional Name: 3-(1-benzyl-4-piperidyl)-6-fluoro-4-phenyl-1,4-dihydroquinazolin-2-one Formula: C26H26FN3O MolecularWeight: 415.502543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(C3=C(C=CC(=C3)F)NC2=O)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1N2C(C3=C(C=CC(=C3)F)NC2=O)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26FN3O/c27-21-11-12-24-23(17-21)25(20-9-5-2-6-10-20)30(26(31)28-24)22-13-15-29(16-14-22)18-19-7-3-1-4-8-19/h1-12,17,22,25H,13-16,18H2,(H,28,31)