6-bromanyl-3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 6-bromo-3-isobutyl-2-(tetrahydrofuran-2-ylmethylsulfanyl)quinazolin-4-one CAS Name: 6-bromo-3-(2-methylpropyl)-2-(2-oxolanylmethylthio)-4-quinazolinone IUPAC Name: 6-bromo-3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 6-bromo-3-isobutyl-2-(tetrahydrofurfurylthio)quinazolin-4-one Formula: C17H21BrN2O2S MolecularWeight: 397.32984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3CCCO3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC3CCCO3

InChI

InChI=1S/C17H21BrN2O2S/c1-11(2)9-20-16(21)14-8-12(18)5-6-15(14)19-17(20)23-10-13-4-3-7-22-13/h5-6,8,11,13H,3-4,7,9-10H2,1-2H3