6-[(4-fluorophenyl)methylsulfanyl]-9-phenyl-purine

Systemtic Name: 6-[(4-fluorophenyl)methylsulfanyl]-9-phenyl-purine Openeye Name: 6-[(4-fluorophenyl)methylsulfanyl]-9-phenyl-purine CAS Name: 6-[(4-fluorophenyl)methylthio]-9-phenylpurine IUPAC Name: 6-[(4-fluorophenyl)methylsulfanyl]-9-phenylpurine Traditional Name: 6-[(4-fluorobenzyl)thio]-9-phenyl-purine Formula: C18H13FN4S MolecularWeight: 336.386023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC3=C2N=CN=C3SCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC3=C2N=CN=C3SCC4=CC=C(C=C4)F

InChI

InChI=1S/C18H13FN4S/c19-14-8-6-13(7-9-14)10-24-18-16-17(20-11-21-18)23(12-22-16)15-4-2-1-3-5-15/h1-9,11-12H,10H2