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

Systemtic Name: N-(4-ethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[3-[(4-fluorophenyl)methyl]-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]quinoxalin-2-yl]sulfanylacetamide Traditional Name: 2-[[3-(4-fluorobenzyl)quinoxalin-2-yl]thio]-N-p-phenetyl-acetamide Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O2S/c1-2-31-20-13-11-19(12-14-20)27-24(30)16-32-25-23(15-17-7-9-18(26)10-8-17)28-21-5-3-4-6-22(21)29-25/h3-14H,2,15-16H2,1H3,(H,27,30)