4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-7-(2-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-7-(2-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-7-(2-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 4-[(2-chloro-6-fluorophenyl)methylthio]-7-(2-methoxyphenyl)-5-phenylpyrrolo[2,3-d]pyrimidine IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-(2-methoxyphenyl)-5-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)thio]-7-(2-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C26H19ClFN3OS MolecularWeight: 475.964963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C3=C2N=CN=C3SCC4=C(C=CC=C4Cl)F)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=C2N=CN=C3SCC4=C(C=CC=C4Cl)F)C5=CC=CC=C5

InChI

InChI=1S/C26H19ClFN3OS/c1-32-23-13-6-5-12-22(23)31-14-18(17-8-3-2-4-9-17)24-25(31)29-16-30-26(24)33-15-19-20(27)10-7-11-21(19)28/h2-14,16H,15H2,1H3