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

Systemtic Name: 5-[(4-fluorophenyl)methyl]-4-oxidanyl-2-(2-prop-2-enylsulfanylethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 2-(2-allylsulfanylethylsulfanyl)-5-[(4-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-[2-(prop-2-enylthio)ethylthio]-1H-pyrimidin-6-one IUPAC Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-(2-prop-2-enylsulfanylethylsulfanyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-(allylthio)ethylthio]-5-(4-fluorobenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C16H17FN2O2S2 MolecularWeight: 352.446783

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)F)O

Isomeric SMILES

C=CCSCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)F)O

InChI

InChI=1S/C16H17FN2O2S2/c1-2-7-22-8-9-23-16-18-14(20)13(15(21)19-16)10-11-3-5-12(17)6-4-11/h2-6H,1,7-10H2,(H2,18,19,20,21)