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acetamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[[7-[(2-chlorophenyl)methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-
SpectraBase Compound ID C4efpvYADIl
InChI InChI=1S/C23H19Cl2F2N5O4S/c1-30-19-18(20(34)31(2)22(30)35)32(11-13-5-3-4-6-16(13)24)21(29-19)37-12-17(33)28-14-7-9-15(10-8-14)36-23(25,26)27/h3-10H,11-12H2,1-2H3,(H,28,33)
InChIKey YNSKYSGHHFIOAQ-UHFFFAOYSA-N
Mol Weight 570.4 g/mol
Molecular Formula C23H19Cl2F2N5O4S
Exact Mass 569.050287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G3uc6s1B9vU
Name 2-[[7-(2-chlorobenzyl)-2,6-diketo-1,3-dimethyl-purin-8-yl]thio]-N-[4-[chloro(difluoro)methoxy]phenyl]acetamide
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Formula C23H19Cl2F2N5O4S
InChI InChI=1S/C23H19Cl2F2N5O4S/c1-30-19-18(20(34)31(2)22(30)35)32(11-13-5-3-4-6-16(13)24)21(29-19)37-12-17(33)28-14-7-9-15(10-8-14)36-23(25,26)27/h3-10H,11-12H2,1-2H3,(H,28,33)
InChIKey YNSKYSGHHFIOAQ-UHFFFAOYSA-N
Molecular Weight 570.399 g/mol
SMILES N(C(CSc1nc2c([n]1Cc1c(Cl)cccc1)C(=O)N(C(N2C)=O)C)=O)c1ccc(OC(F)(Cl)F)cc1
SPLASH splash10-004i-3922010000-59649c6e2ee1679794d1
Synonyms N-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]-2-[7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-ethanamide N-[4-[chloro(difluoro)methoxy]phenyl]-2-[7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-purin-8-yl]sulfanyl-acetamide N-[4-[chloro(difluoro)methoxy]phenyl]-2-[[7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-8-purinyl]thio]acetamide
Wiley ID 1462737