2-[(3-fluorophenyl)methylsulfanyl]-3-(4-phenoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(4-phenoxyphenyl)quinazolin-4-one Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(4-phenoxyphenyl)quinazolin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-(4-phenoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(4-phenoxyphenyl)quinazolin-4-one Traditional Name: 2-[(3-fluorobenzyl)thio]-3-(4-phenoxyphenyl)quinazolin-4-one Formula: C27H19FN2O2S MolecularWeight: 454.515363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)F

InChI

InChI=1S/C27H19FN2O2S/c28-20-8-6-7-19(17-20)18-33-27-29-25-12-5-4-11-24(25)26(31)30(27)21-13-15-23(16-14-21)32-22-9-2-1-3-10-22/h1-17H,18H2