4-[1-[[5-(2-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]thiomorpholine

Systemtic Name: 4-[1-[[5-(2-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]thiomorpholine Openeye Name: 4-[1-[[5-(2-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]-4-piperidyl]thiomorpholine CAS Name: 4-[1-[[5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-4-piperidinyl]thiomorpholine IUPAC Name: 4-[1-[[5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]piperidin-4-yl]thiomorpholine Traditional Name: 4-[1-[[5-(2-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]-4-piperidyl]thiomorpholine Formula: C20H27FN4OS MolecularWeight: 390.517983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C(C=NN2)CN3CCC(CC3)N4CCSCC4)F

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C(C=NN2)CN3CCC(CC3)N4CCSCC4)F

InChI

InChI=1S/C20H27FN4OS/c1-26-17-2-3-18(19(21)12-17)20-15(13-22-23-20)14-24-6-4-16(5-7-24)25-8-10-27-11-9-25/h2-3,12-13,16H,4-11,14H2,1H3,(H,22,23)