N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2-pyridylthio)acetamide Formula: C16H16N2O3S MolecularWeight: 316.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)CSC3=CC=CC=N3

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)CNC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C16H16N2O3S/c19-15(11-22-16-7-3-4-8-17-16)18-9-12-10-20-13-5-1-2-6-14(13)21-12/h1-8,12H,9-11H2,(H,18,19)/t12-/m1/s1