2-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-fluoranyl-phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine

Systemtic Name: 2-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-fluoranyl-phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Openeye Name: 2-[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-fluoro-phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine CAS Name: 2-[2-[(5-bromo-2-methoxyphenyl)methylthio]-3-fluorophenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine IUPAC Name: 2-[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-fluorophenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Traditional Name: 2-[2-[(5-bromo-2-methoxy-benzyl)thio]-3-fluoro-phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Formula: C20H22BrFN2OS MolecularWeight: 437.368883

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC(=NC1)C2=C(C(=CC=C2)F)SCC3=C(C=CC(=C3)Br)OC)C

Isomeric SMILES

CC1(CNC(=NC1)C2=C(C(=CC=C2)F)SCC3=C(C=CC(=C3)Br)OC)C

InChI

InChI=1S/C20H22BrFN2OS/c1-20(2)11-23-19(24-12-20)15-5-4-6-16(22)18(15)26-10-13-9-14(21)7-8-17(13)25-3/h4-9H,10-12H2,1-3H3,(H,23,24)