2-[2-(4-bromophenyl)-6-fluoranyl-quinazolin-4-yl]sulfanyl-N-(2,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)-6-fluoranyl-quinazolin-4-yl]sulfanyl-N-(2,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[2-(4-bromophenyl)-6-fluoro-quinazolin-4-yl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide CAS Name: 2-[[2-(4-bromophenyl)-6-fluoro-4-quinazolinyl]thio]-N-(2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[2-(4-bromophenyl)-6-fluoroquinazolin-4-yl]sulfanyl-N-(2,5-dimethoxyphenyl)acetamide Traditional Name: 2-[[2-(4-bromophenyl)-6-fluoro-quinazolin-4-yl]thio]-N-(2,5-dimethoxyphenyl)acetamide Formula: C24H19BrFN3O3S MolecularWeight: 528.393363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H19BrFN3O3S/c1-31-17-8-10-21(32-2)20(12-17)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)