2-[5-bromanyl-2-ethoxy-4-[3-(4-fluorophenyl)-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[5-bromanyl-2-ethoxy-4-[3-(4-fluorophenyl)-4-oxidanylidene-1,2-dihydroquinazolin-2-yl]phenoxy]ethanenitrile Openeye Name: 2-[5-bromo-2-ethoxy-4-[3-(4-fluorophenyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile CAS Name: 2-[5-bromo-2-ethoxy-4-[3-(4-fluorophenyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile IUPAC Name: 2-[5-bromo-2-ethoxy-4-[3-(4-fluorophenyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile Traditional Name: 2-[5-bromo-2-ethoxy-4-[3-(4-fluorophenyl)-4-keto-1,2-dihydroquinazolin-2-yl]phenoxy]acetonitrile Formula: C24H19BrFN3O3 MolecularWeight: 496.328363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F)Br)OCC#N

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F)Br)OCC#N

InChI

InChI=1S/C24H19BrFN3O3/c1-2-31-21-13-18(19(25)14-22(21)32-12-11-27)23-28-20-6-4-3-5-17(20)24(30)29(23)16-9-7-15(26)8-10-16/h3-10,13-14,23,28H,2,12H2,1H3