2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2-quinolin-8-ylethyl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2-quinolin-8-ylethyl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(8-quinolyl)ethyl]acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[2-(8-quinolinyl)ethyl]acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2-quinolin-8-ylethyl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[2-(8-quinolyl)ethyl]acetamide Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)NCCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)NCCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H20N2O3S/c24-20(14-27-17-6-7-18-19(13-17)26-12-11-25-18)22-10-8-16-4-1-3-15-5-2-9-23-21(15)16/h1-7,9,13H,8,10-12,14H2,(H,22,24)