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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-isopentyl-quinazolin-4-one CAS Name: 2-[(4-fluorophenyl)methylthio]-3-(3-methylbutyl)-4-quinazolinone IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one Traditional Name: 2-[(4-fluorobenzyl)thio]-3-isoamyl-quinazolin-4-one Formula: C20H21FN2OS MolecularWeight: 356.456943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2OS/c1-14(2)11-12-23-19(24)17-5-3-4-6-18(17)22-20(23)25-13-15-7-9-16(21)10-8-15/h3-10,14H,11-13H2,1-2H3