N-tert-butyl-2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[8-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-tert-butyl-2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-tert-butyl-2-[[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]acetamide Formula: C22H24FN3OS MolecularWeight: 397.508863

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC(C)(C)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC(C)(C)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3OS/c1-5-14-7-6-8-17-19(14)24-20(15-9-11-16(23)12-10-15)25-21(17)28-13-18(27)26-22(2,3)4/h6-12H,5,13H2,1-4H3,(H,26,27)