N-[2,4-bis(fluoranyl)phenyl]-2-[(9-ethyl-6-oxidanylidene-3H-purin-8-yl)sulfanyl]ethanamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-2-[(9-ethyl-6-oxidanylidene-3H-purin-8-yl)sulfanyl]ethanamide Openeye Name: N-(2,4-difluorophenyl)-2-[(9-ethyl-6-oxo-3H-purin-8-yl)sulfanyl]acetamide CAS Name: N-(2,4-difluorophenyl)-2-[(9-ethyl-6-oxo-3H-purin-8-yl)thio]acetamide IUPAC Name: N-(2,4-difluorophenyl)-2-[(9-ethyl-6-oxo-3H-purin-8-yl)sulfanyl]acetamide Traditional Name: N-(2,4-difluorophenyl)-2-[(9-ethyl-6-keto-3H-purin-8-yl)thio]acetamide Formula: C15H13F2N5O2S MolecularWeight: 365.357826

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CCN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C15H13F2N5O2S/c1-2-22-13-12(14(24)19-7-18-13)21-15(22)25-6-11(23)20-10-4-3-8(16)5-9(10)17/h3-5,7H,2,6H2,1H3,(H,20,23)(H,18,19,24)