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

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(4-bromophenyl)sulfonylethyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-bromophenyl)sulfonylethyl]-5-(4-fluorophenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethyl]-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-brosylethyl)-5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H14BrFN2O3S2 MolecularWeight: 493.369163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC3=C2C(=O)N(C=N3)CCS(=O)(=O)C4=CC=C(C=C4)Br)F

Isomeric SMILES

C1=CC(=CC=C1C2=CSC3=C2C(=O)N(C=N3)CCS(=O)(=O)C4=CC=C(C=C4)Br)F

InChI

InChI=1S/C20H14BrFN2O3S2/c21-14-3-7-16(8-4-14)29(26,27)10-9-24-12-23-19-18(20(24)25)17(11-28-19)13-1-5-15(22)6-2-13/h1-8,11-12H,9-10H2