6-azanyl-9-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,7-dihydropurin-8-one

Systemtic Name: 6-azanyl-9-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,7-dihydropurin-8-one Openeye Name: 6-amino-9-[(4-fluorophenyl)methyl]-2-thioxo-1,7-dihydropurin-8-one CAS Name: 6-amino-9-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,7-dihydropurin-8-one IUPAC Name: 6-amino-9-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,7-dihydropurin-8-one Traditional Name: 6-amino-9-(4-fluorobenzyl)-2-thioxo-1,7-dihydropurin-8-one Formula: C12H10FN5OS MolecularWeight: 291.304103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C3=NC(=S)NC(=C3NC2=O)N)F

Isomeric SMILES

C1=CC(=CC=C1CN2C3=NC(=S)NC(=C3NC2=O)N)F

InChI

InChI=1S/C12H10FN5OS/c13-7-3-1-6(2-4-7)5-18-10-8(15-12(18)19)9(14)16-11(20)17-10/h1-4H,5H2,(H,15,19)(H3,14,16,17,20)