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

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(1-methyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[(2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=CC(=O)N(C4=CC=CC=C43)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=CC(=O)N(C4=CC=CC=C43)C

InChI

InChI=1S/C22H22N2O4S/c1-14(15-7-8-18-19(11-15)28-10-9-27-18)23-21(25)13-29-20-12-22(26)24(2)17-6-4-3-5-16(17)20/h3-8,11-12,14H,9-10,13H2,1-2H3,(H,23,25)