N-(2,4-dimethylphenyl)-2-[3-[(2-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[3-[(2-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[3-[(2-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanyl-acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[[3-[(2-methoxyphenyl)methyl]-2-quinoxalinyl]thio]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[3-[(2-methoxyphenyl)methyl]quinoxalin-2-yl]sulfanylacetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[(3-o-anisylquinoxalin-2-yl)thio]acetamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=CC=C4OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C2CC4=CC=CC=C4OC)C

InChI

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