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5-[(3-chloro-4-fluorophenyl)sulfonyl]-4-(p-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
SpectraBase Compound ID 1fJUeICHo5x
InChI InChI=1S/C20H17ClFNO3S2/c1-26-14-4-2-13(3-5-14)20-16-9-11-27-19(16)8-10-23(20)28(24,25)15-6-7-18(22)17(21)12-15/h2-7,9,11-12,20H,8,10H2,1H3
InChIKey NIEZRLKORNYTLB-UHFFFAOYSA-N
Mol Weight 437.93 g/mol
Molecular Formula C20H17ClFNO3S2
Exact Mass 437.032242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40zflPQh2rE
Name 5-(3-Chloranyl-4-fluoranyl-phenyl)sulfonyl-4-(4-methoxyphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
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Formula C20H17ClFNO3S2
InChI InChI=1S/C20H17ClFNO3S2/c1-26-14-4-2-13(3-5-14)20-16-9-11-27-19(16)8-10-23(20)28(24,25)15-6-7-18(22)17(21)12-15/h2-7,9,11-12,20H,8,10H2,1H3
InChIKey NIEZRLKORNYTLB-UHFFFAOYSA-N
Molecular Weight 437.931 g/mol
SMILES COc1ccc(C2c3c(scc3)CCN2S(c2cc(c(F)cc2)Cl)(=O)=O)cc1
SPLASH splash10-0006-2690000000-165b58ea0a9f4dcd1b9f
Synonyms 5-(3-Chloro-4-fluoro-phenyl)sulfonyl-4-(4-methoxyphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine 5-[(3-chloro-4-fluorophenyl)sulfonyl]-4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
Wiley ID 1446149