N-(3-ethanoylphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetylphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanyl-acetamide CAS Name: N-(3-acetylphenyl)-2-[[3-[(4-fluorophenyl)methyl]-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanylacetamide Traditional Name: N-(3-acetylphenyl)-2-[[3-(4-fluorobenzyl)quinoxalin-2-yl]thio]acetamide Formula: C25H20FN3O2S MolecularWeight: 445.508603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H20FN3O2S/c1-16(30)18-5-4-6-20(14-18)27-24(31)15-32-25-23(13-17-9-11-19(26)12-10-17)28-21-7-2-3-8-22(21)29-25/h2-12,14H,13,15H2,1H3,(H,27,31)