3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-bromo-2-fluoro-phenyl)methyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-bromo-2-fluorophenyl)methyl]-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-bromo-2-fluoro-benzyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H14BrFN2OS MolecularWeight: 429.305363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H14BrFN2OS/c1-12-2-4-13(5-3-12)16-10-26-19-18(16)20(25)24(11-23-19)9-14-6-7-15(21)8-17(14)22/h2-8,10-11H,9H2,1H3