N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC(C)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC(C)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22N2O3S/c1-14-11-22(24-18-6-4-3-5-17(14)18)28-13-21(25)23-15(2)16-7-8-19-20(12-16)27-10-9-26-19/h3-8,11-12,15H,9-10,13H2,1-2H3,(H,23,25)