9-[(4-fluorophenyl)methyl]-8-piperidin-4-ylsulfonyl-purine

Systemtic Name: 9-[(4-fluorophenyl)methyl]-8-piperidin-4-ylsulfonyl-purine Openeye Name: 9-[(4-fluorophenyl)methyl]-8-(4-piperidylsulfonyl)purine CAS Name: 9-[(4-fluorophenyl)methyl]-8-(4-piperidinylsulfonyl)purine IUPAC Name: 9-[(4-fluorophenyl)methyl]-8-piperidin-4-ylsulfonylpurine Traditional Name: 9-(4-fluorobenzyl)-8-(4-piperidylsulfonyl)purine Formula: C17H18FN5O2S MolecularWeight: 375.420523

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1S(=O)(=O)C2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)F

Isomeric SMILES

C1CNCCC1S(=O)(=O)C2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C17H18FN5O2S/c18-13-3-1-12(2-4-13)10-23-16-15(9-20-11-21-16)22-17(23)26(24,25)14-5-7-19-8-6-14/h1-4,9,11,14,19H,5-8,10H2