2-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-fluoranyl-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol

Systemtic Name: 2-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-fluoranyl-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Openeye Name: 2-[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-fluoro-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol CAS Name: 2-[2-[(5-bromo-2-methoxyphenyl)methylthio]-3-fluorophenyl]-1,4,5,6-tetrahydropyrimidin-5-ol IUPAC Name: 2-[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-fluorophenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Traditional Name: 2-[2-[(5-bromo-2-methoxy-benzyl)thio]-3-fluoro-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Formula: C18H18BrFN2O2S MolecularWeight: 425.315123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC=C2F)C3=NCC(CN3)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC=C2F)C3=NCC(CN3)O

InChI

InChI=1S/C18H18BrFN2O2S/c1-24-16-6-5-12(19)7-11(16)10-25-17-14(3-2-4-15(17)20)18-21-8-13(23)9-22-18/h2-7,13,23H,8-10H2,1H3,(H,21,22)