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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC(=CC=C4)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC(=CC=C4)OC

InChI

InChI=1S/C26H25N3O2S/c1-3-19-10-4-5-12-21(19)28-25(30)17-32-26-24(16-18-9-8-11-20(15-18)31-2)27-22-13-6-7-14-23(22)29-26/h4-15H,3,16-17H2,1-2H3,(H,28,30)