3-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-bromobenzyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C19H12BrFN2OS MolecularWeight: 415.278783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H12BrFN2OS/c20-14-3-1-2-12(8-14)9-23-11-22-18-17(19(23)24)16(10-25-18)13-4-6-15(21)7-5-13/h1-8,10-11H,9H2