2-azanyl-8-[(4-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-[(4-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-6-one Openeye Name: 2-amino-8-[(4-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-6-one CAS Name: 2-amino-8-[(4-fluorophenyl)methylthio]-3,7-dihydropurin-6-one IUPAC Name: 2-amino-8-[(4-fluorophenyl)methylsulfanyl]-3,7-dihydropurin-6-one Traditional Name: 2-amino-8-[(4-fluorobenzyl)thio]-3,7-dihydropurin-6-one Formula: C12H10FN5OS MolecularWeight: 291.304103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC3=C(N2)C(=O)N=C(N3)N)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC3=C(N2)C(=O)N=C(N3)N)F

InChI

InChI=1S/C12H10FN5OS/c13-7-3-1-6(2-4-7)5-20-12-15-8-9(17-12)16-11(14)18-10(8)19/h1-4H,5H2,(H4,14,15,16,17,18,19)