2-[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-butyl-quinazolin-4-one

Systemtic Name: 2-[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-3-butyl-quinazolin-4-one Openeye Name: 3-butyl-2-[2-(3,4-difluorophenyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-butyl-2-[[2-(3,4-difluorophenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-butyl-2-[2-(3,4-difluorophenyl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-butyl-2-[[2-(3,4-difluorophenyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C20H18F2N2O2S MolecularWeight: 388.430926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C20H18F2N2O2S/c1-2-3-10-24-19(26)14-6-4-5-7-17(14)23-20(24)27-12-18(25)13-8-9-15(21)16(22)11-13/h4-9,11H,2-3,10,12H2,1H3