N-(1,3-benzodioxol-5-yl)-2-[6-fluoranyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[6-fluoranyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[6-fluoro-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[6-fluoro-2-(4-fluorophenyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[6-fluoro-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[6-fluoro-2-(4-fluorophenyl)quinazolin-4-yl]thio]acetamide Formula: C23H15F2N3O3S MolecularWeight: 451.445306

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC(=NC4=C3C=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC(=NC4=C3C=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H15F2N3O3S/c24-14-3-1-13(2-4-14)22-27-18-7-5-15(25)9-17(18)23(28-22)32-11-21(29)26-16-6-8-19-20(10-16)31-12-30-19/h1-10H,11-12H2,(H,26,29)