1-(4-fluorophenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-fluorophenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(4-fluorophenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(4-fluorophenyl)-2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]thio]ethanone IUPAC Name: 1-(4-fluorophenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(4-fluorophenyl)-2-[(6-pyrrolidinopyrimidin-4-yl)thio]ethanone Formula: C16H16FN3OS MolecularWeight: 317.381143

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H16FN3OS/c17-13-5-3-12(4-6-13)14(21)10-22-16-9-15(18-11-19-16)20-7-1-2-8-20/h3-6,9,11H,1-2,7-8,10H2