N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-[(3-methyl-2-quinoxalinyl)thio]acetamide IUPAC Name: N-[1-(4-methoxyphenyl)-2-methylpropyl]-2-(3-methylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-[1-(4-methoxyphenyl)-2-methyl-propyl]-2-[(3-methylquinoxalin-2-yl)thio]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1SCC(=O)NC(C3=CC=C(C=C3)OC)C(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1SCC(=O)NC(C3=CC=C(C=C3)OC)C(C)C

InChI

InChI=1S/C22H25N3O2S/c1-14(2)21(16-9-11-17(27-4)12-10-16)25-20(26)13-28-22-15(3)23-18-7-5-6-8-19(18)24-22/h5-12,14,21H,13H2,1-4H3,(H,25,26)