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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-4-hydroxy-5-(1-naphthylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[(4-fluorophenyl)methylthio]-4-hydroxy-5-(1-naphthalenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-4-hydroxy-5-(naphthalen-1-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[(4-fluorobenzyl)thio]-4-hydroxy-5-(1-naphthylmethyl)-1H-pyrimidin-6-one Formula: C22H17FN2O2S MolecularWeight: 392.445983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC3=C(N=C(NC3=O)SCC4=CC=C(C=C4)F)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC3=C(N=C(NC3=O)SCC4=CC=C(C=C4)F)O

InChI

InChI=1S/C22H17FN2O2S/c23-17-10-8-14(9-11-17)13-28-22-24-20(26)19(21(27)25-22)12-16-6-3-5-15-4-1-2-7-18(15)16/h1-11H,12-13H2,(H2,24,25,26,27)