N-(4-fluorophenyl)-2-[(6-oxidanylidene-9-phenyl-3H-purin-8-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[(6-oxidanylidene-9-phenyl-3H-purin-8-yl)sulfanyl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[(6-oxo-9-phenyl-3H-purin-8-yl)sulfanyl]acetamide CAS Name: N-(4-fluorophenyl)-2-[(6-oxo-9-phenyl-3H-purin-8-yl)thio]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[(6-oxo-9-phenyl-3H-purin-8-yl)sulfanyl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[(6-keto-9-phenyl-3H-purin-8-yl)thio]acetamide Formula: C19H14FN5O2S MolecularWeight: 395.410163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C19H14FN5O2S/c20-12-6-8-13(9-7-12)23-15(26)10-28-19-24-16-17(21-11-22-18(16)27)25(19)14-4-2-1-3-5-14/h1-9,11H,10H2,(H,23,26)(H,21,22,27)