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

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-(2-fluorophenyl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(2-fluorophenyl)quinazolin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-3-(2-fluorophenyl)quinazolin-4-one Formula: C25H23FN2OS MolecularWeight: 418.526323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4F

InChI

InChI=1S/C25H23FN2OS/c1-25(2,3)18-14-12-17(13-15-18)16-30-24-27-21-10-6-4-8-19(21)23(29)28(24)22-11-7-5-9-20(22)26/h4-15H,16H2,1-3H3