2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanyl-5-(2-propan-2-ylsulfanylethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanyl-5-(2-propan-2-ylsulfanylethyl)-1H-pyrimidin-6-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-4-hydroxy-5-(2-isopropylsulfanylethyl)-1H-pyrimidin-6-one CAS Name: 2-[(4-fluorophenyl)methylthio]-4-hydroxy-5-[2-(propan-2-ylthio)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-4-hydroxy-5-(2-propan-2-ylsulfanylethyl)-1H-pyrimidin-6-one Traditional Name: 2-[(4-fluorobenzyl)thio]-4-hydroxy-5-[2-(isopropylthio)ethyl]-1H-pyrimidin-6-one Formula: C16H19FN2O2S2 MolecularWeight: 354.462663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCCC1=C(N=C(NC1=O)SCC2=CC=C(C=C2)F)O

Isomeric SMILES

CC(C)SCCC1=C(N=C(NC1=O)SCC2=CC=C(C=C2)F)O

InChI

InChI=1S/C16H19FN2O2S2/c1-10(2)22-8-7-13-14(20)18-16(19-15(13)21)23-9-11-3-5-12(17)6-4-11/h3-6,10H,7-9H2,1-2H3,(H2,18,19,20,21)