2-[3-(3-chloranyl-4-fluoranyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[3-(3-chloranyl-4-fluoranyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-(4-fluorophenyl)ethanamide Openeye Name: 2-[3-(3-chloro-4-fluoro-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-(4-fluorophenyl)acetamide CAS Name: 2-[[3-(3-chloro-4-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-2-(4-fluorophenyl)acetamide IUPAC Name: 2-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-2-(4-fluorophenyl)acetamide Traditional Name: 2-[[3-(3-chloro-4-fluoro-phenyl)-4-keto-quinazolin-2-yl]thio]-2-(4-fluorophenyl)acetamide Formula: C22H14ClF2N3O2S MolecularWeight: 457.880266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SC(C3=CC=C(C=C3)F)C(=O)N)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SC(C3=CC=C(C=C3)F)C(=O)N)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H14ClF2N3O2S/c23-16-11-14(9-10-17(16)25)28-21(30)15-3-1-2-4-18(15)27-22(28)31-19(20(26)29)12-5-7-13(24)8-6-12/h1-11,19H,(H2,26,29)