2-[3-fluoranyl-2-(naphthalen-1-ylmethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[3-fluoranyl-2-(naphthalen-1-ylmethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[3-fluoro-2-(1-naphthylmethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[3-fluoro-2-(1-naphthalenylmethylthio)phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[3-fluoro-2-(naphthalen-1-ylmethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[3-fluoro-2-(1-naphthylmethylthio)phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C21H19FN2S MolecularWeight: 350.452363

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)C2=C(C(=CC=C2)F)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CNC(=NC1)C2=C(C(=CC=C2)F)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H19FN2S/c22-19-11-4-10-18(21-23-12-5-13-24-21)20(19)25-14-16-8-3-7-15-6-1-2-9-17(15)16/h1-4,6-11H,5,12-14H2,(H,23,24)