3-[3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[(5-fluoro-2-methoxyphenyl)methylthio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[(5-fluoro-2-methoxy-benzyl)thio]propyl]-1H-benzimidazol-2-one Formula: C18H19FN2O2S MolecularWeight: 346.419063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CSCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

COC1=C(C=C(C=C1)F)CSCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C18H19FN2O2S/c1-23-17-8-7-14(19)11-13(17)12-24-10-4-9-21-16-6-3-2-5-15(16)20-18(21)22/h2-3,5-8,11H,4,9-10,12H2,1H3,(H,20,22)