7-(4-bromophenyl)-4-[(2-chlorophenyl)methylsulfanyl]-5-phenyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-(4-bromophenyl)-4-[(2-chlorophenyl)methylsulfanyl]-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 7-(4-bromophenyl)-4-[(2-chlorophenyl)methylsulfanyl]-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 7-(4-bromophenyl)-4-[(2-chlorophenyl)methylthio]-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 7-(4-bromophenyl)-4-[(2-chlorophenyl)methylsulfanyl]-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-(4-bromophenyl)-4-[(2-chlorobenzyl)thio]-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C25H17BrClN3S MolecularWeight: 506.84458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)SCC4=CC=CC=C4Cl)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)SCC4=CC=CC=C4Cl)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H17BrClN3S/c26-19-10-12-20(13-11-19)30-14-21(17-6-2-1-3-7-17)23-24(30)28-16-29-25(23)31-15-18-8-4-5-9-22(18)27/h1-14,16H,15H2