2-methyl-1-(1-pyridin-4-ylsulfanylpiperidin-4-yl)propan-1-one

Systemtic Name: 2-methyl-1-(1-pyridin-4-ylsulfanylpiperidin-4-yl)propan-1-one Openeye Name: 2-methyl-1-[1-(4-pyridylsulfanyl)-4-piperidyl]propan-1-one CAS Name: 2-methyl-1-[1-(pyridin-4-ylthio)-4-piperidinyl]-1-propanone IUPAC Name: 2-methyl-1-(1-pyridin-4-ylsulfanylpiperidin-4-yl)propan-1-one Traditional Name: 2-methyl-1-[1-(4-pyridylthio)-4-piperidyl]propan-1-one Formula: C14H20N2OS MolecularWeight: 264.3864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1CCN(CC1)SC2=CC=NC=C2

Isomeric SMILES

CC(C)C(=O)C1CCN(CC1)SC2=CC=NC=C2

InChI

InChI=1S/C14H20N2OS/c1-11(2)14(17)12-5-9-16(10-6-12)18-13-3-7-15-8-4-13/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3