5-[(4-fluorophenyl)methyl]-4-oxidanyl-2-(2-pentylsulfanylethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-4-oxidanyl-2-(2-pentylsulfanylethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-(2-pentylsulfanylethylsulfanyl)-1H-pyrimidin-6-one CAS Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-[2-(pentylthio)ethylthio]-1H-pyrimidin-6-one IUPAC Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-(2-pentylsulfanylethylsulfanyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-(amylthio)ethylthio]-5-(4-fluorobenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C18H23FN2O2S2 MolecularWeight: 382.515823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)F)O

Isomeric SMILES

CCCCCSCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)F)O

InChI

InChI=1S/C18H23FN2O2S2/c1-2-3-4-9-24-10-11-25-18-20-16(22)15(17(23)21-18)12-13-5-7-14(19)8-6-13/h5-8H,2-4,9-12H2,1H3,(H2,20,21,22,23)