2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-5-(2-methylsulfonylphenyl)-1,3-thiazole

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-5-(2-methylsulfonylphenyl)-1,3-thiazole Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-5-(2-methylsulfonylphenyl)thiazole CAS Name: 2-[(3-bromophenyl)methylthio]-4-(4-fluorophenyl)-5-(2-methylsulfonylphenyl)thiazole IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-5-(2-methylsulfonylphenyl)-1,3-thiazole Traditional Name: 2-[(3-bromobenzyl)thio]-4-(4-fluorophenyl)-5-(2-mesylphenyl)thiazole Formula: C23H17BrFNO2S3 MolecularWeight: 534.483983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=C(N=C(S2)SCC3=CC(=CC=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=C(N=C(S2)SCC3=CC(=CC=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H17BrFNO2S3/c1-31(27,28)20-8-3-2-7-19(20)22-21(16-9-11-18(25)12-10-16)26-23(30-22)29-14-15-5-4-6-17(24)13-15/h2-13H,14H2,1H3