5-(4-bromophenyl)-6-ethyl-3-[(2-fluorophenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-6-ethyl-3-[(2-fluorophenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-ethyl-3-[(2-fluorophenyl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-ethyl-3-[(2-fluorophenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-6-ethyl-3-[(2-fluorophenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-ethyl-3-(2-fluorobenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H16BrFN2OS MolecularWeight: 443.331943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC=C3F)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC=C3F)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrFN2OS/c1-2-17-18(13-7-9-15(22)10-8-13)19-20(27-17)24-12-25(21(19)26)11-14-5-3-4-6-16(14)23/h3-10,12H,2,11H2,1H3