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

Systemtic Name: 5-[(4-fluorophenyl)methyl]-2-[2-(2-methylpropylsulfanyl)ethylsulfanyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-(2-isobutylsulfanylethylsulfanyl)-1H-pyrimidin-6-one CAS Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-[2-(2-methylpropylthio)ethylthio]-1H-pyrimidin-6-one IUPAC Name: 5-[(4-fluorophenyl)methyl]-4-hydroxy-2-[2-(2-methylpropylsulfanyl)ethylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 5-(4-fluorobenzyl)-4-hydroxy-2-[2-(isobutylthio)ethylthio]-1H-pyrimidin-6-one Formula: C17H21FN2O2S2 MolecularWeight: 368.489243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)F)O

Isomeric SMILES

CC(C)CSCCSC1=NC(=C(C(=O)N1)CC2=CC=C(C=C2)F)O

InChI

InChI=1S/C17H21FN2O2S2/c1-11(2)10-23-7-8-24-17-19-15(21)14(16(22)20-17)9-12-3-5-13(18)6-4-12/h3-6,11H,7-10H2,1-2H3,(H2,19,20,21,22)