2-[(4-fluorophenyl)methylsulfanyl]-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-6-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4-fluorophenyl)methylthio]-6-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-6-(2-oxo-2-pyrrolidin-1-ylethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4-fluorobenzyl)thio]-6-(2-keto-2-pyrrolidino-ethyl)-1H-pyrimidin-4-one Formula: C17H18FN3O2S MolecularWeight: 347.407123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C1)C(=O)CC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H18FN3O2S/c18-13-5-3-12(4-6-13)11-24-17-19-14(9-15(22)20-17)10-16(23)21-7-1-2-8-21/h3-6,9H,1-2,7-8,10-11H2,(H,19,20,22)