2-[2-(4-bromophenyl)-6-fluoranyl-quinazolin-4-yl]sulfanyl-N-(2,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)-6-fluoranyl-quinazolin-4-yl]sulfanyl-N-(2,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[2-(4-bromophenyl)-6-fluoro-quinazolin-4-yl]sulfanyl-N-(2,4-dimethoxyphenyl)acetamide CAS Name: 2-[[2-(4-bromophenyl)-6-fluoro-4-quinazolinyl]thio]-N-(2,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[2-(4-bromophenyl)-6-fluoroquinazolin-4-yl]sulfanyl-N-(2,4-dimethoxyphenyl)acetamide Traditional Name: 2-[[2-(4-bromophenyl)-6-fluoro-quinazolin-4-yl]thio]-N-(2,4-dimethoxyphenyl)acetamide Formula: C24H19BrFN3O3S MolecularWeight: 528.393363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C24H19BrFN3O3S/c1-31-17-8-10-20(21(12-17)32-2)27-22(30)13-33-24-18-11-16(26)7-9-19(18)28-23(29-24)14-3-5-15(25)6-4-14/h3-12H,13H2,1-2H3,(H,27,30)