8-[(2-fluorophenyl)methylsulfanyl]-9-(4-methylphenyl)-3H-purin-6-one

Systemtic Name: 8-[(2-fluorophenyl)methylsulfanyl]-9-(4-methylphenyl)-3H-purin-6-one Openeye Name: 8-[(2-fluorophenyl)methylsulfanyl]-9-(p-tolyl)-3H-purin-6-one CAS Name: 8-[(2-fluorophenyl)methylthio]-9-(4-methylphenyl)-3H-purin-6-one IUPAC Name: 8-[(2-fluorophenyl)methylsulfanyl]-9-(4-methylphenyl)-3H-purin-6-one Traditional Name: 8-[(2-fluorobenzyl)thio]-9-(p-tolyl)-3H-purin-6-one Formula: C19H15FN4OS MolecularWeight: 366.412003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=CC=CC=C4F

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=CC=CC=C4F

InChI

InChI=1S/C19H15FN4OS/c1-12-6-8-14(9-7-12)24-17-16(18(25)22-11-21-17)23-19(24)26-10-13-4-2-3-5-15(13)20/h2-9,11H,10H2,1H3,(H,21,22,25)