2-[3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[3-[(3-methoxyphenyl)methyl]-2-quinoxalinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[3-[(3-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[(3-m-anisylquinoxalin-2-yl)thio]-N-phenethyl-acetamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=NC3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CC2=NC3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2S/c1-31-21-11-7-10-20(16-21)17-24-26(29-23-13-6-5-12-22(23)28-24)32-18-25(30)27-15-14-19-8-3-2-4-9-19/h2-13,16H,14-15,17-18H2,1H3,(H,27,30)