3-fluoranyl-5-[3-(4-methylpiperidin-1-yl)thieno[2,3-b]pyridin-2-yl]sulfonyl-benzenecarbonitrile

Systemtic Name: 3-fluoranyl-5-[3-(4-methylpiperidin-1-yl)thieno[2,3-b]pyridin-2-yl]sulfonyl-benzenecarbonitrile Openeye Name: 3-fluoro-5-[3-(4-methyl-1-piperidyl)thieno[2,3-b]pyridin-2-yl]sulfonyl-benzonitrile CAS Name: 3-fluoro-5-[[3-(4-methyl-1-piperidinyl)-2-thieno[2,3-b]pyridinyl]sulfonyl]benzonitrile IUPAC Name: 3-fluoro-5-[3-(4-methylpiperidin-1-yl)thieno[2,3-b]pyridin-2-yl]sulfonylbenzonitrile Traditional Name: 3-fluoro-5-[3-(4-methylpiperidino)thieno[2,3-b]pyridin-2-yl]sulfonyl-benzonitrile Formula: C20H18FN3O2S2 MolecularWeight: 415.504223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(SC3=C2C=CC=N3)S(=O)(=O)C4=CC(=CC(=C4)F)C#N

Isomeric SMILES

CC1CCN(CC1)C2=C(SC3=C2C=CC=N3)S(=O)(=O)C4=CC(=CC(=C4)F)C#N

InChI

InChI=1S/C20H18FN3O2S2/c1-13-4-7-24(8-5-13)18-17-3-2-6-23-19(17)27-20(18)28(25,26)16-10-14(12-22)9-15(21)11-16/h2-3,6,9-11,13H,4-5,7-8H2,1H3