N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(2-quinolylthio)acetamide Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H18N2O3S/c1-13(15-6-8-17-18(10-15)25-12-24-17)21-19(23)11-26-20-9-7-14-4-2-3-5-16(14)22-20/h2-10,13H,11-12H2,1H3,(H,21,23)