1-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[3-[5-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]-2-(2-thienyl)ethanone CAS Name: 1-[3-(5-pyridin-4-yl-4-pyrimidinyl)-1-piperidinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[3-[5-(4-pyridyl)pyrimidin-4-yl]piperidino]-2-(2-thienyl)ethanone Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2=CC=CS2)C3=NC=NC=C3C4=CC=NC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)CC2=CC=CS2)C3=NC=NC=C3C4=CC=NC=C4

InChI

InChI=1S/C20H20N4OS/c25-19(11-17-4-2-10-26-17)24-9-1-3-16(13-24)20-18(12-22-14-23-20)15-5-7-21-8-6-15/h2,4-8,10,12,14,16H,1,3,9,11,13H2