1-phenyl-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-phenyl-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-phenyl-2-[6-(1-piperidyl)pyrimidin-4-yl]sulfanyl-ethanone CAS Name: 1-phenyl-2-[[6-(1-piperidinyl)-4-pyrimidinyl]thio]ethanone IUPAC Name: 1-phenyl-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-phenyl-2-[(6-piperidinopyrimidin-4-yl)thio]ethanone Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3OS/c21-15(14-7-3-1-4-8-14)12-22-17-11-16(18-13-19-17)20-9-5-2-6-10-20/h1,3-4,7-8,11,13H,2,5-6,9-10,12H2