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(R)-N-[1-(3-Chlorothien-2-yl)methyl]propyl]-N-(2-fluoro-3-nitropyridin-4-yl)-4-methylbenzenesulfonamide
SpectraBase Compound ID WUnndIpMV7
InChI InChI=1S/C20H19ClFN3O4S2/c1-3-14(12-18-16(21)9-11-30-18)24(17-8-10-23-20(22)19(17)25(26)27)31(28,29)15-6-4-13(2)5-7-15/h4-11,14H,3,12H2,1-2H3/t14-/m1/s1
InChIKey QDOMKIPUFYNFGC-CQSZACIVSA-N
Mol Weight 483.96 g/mol
Molecular Formula C20H19ClFN3O4S2
Exact Mass 483.048954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNf5GdeiFN3
Name (R)-N-[1-(3-Chlorothien-2-yl)methyl]propyl]-N-(2-fluoro-3-nitropyridin-4-yl)-4-methylbenzenesulfonamide
Comments Less than 3 mono-isotopic peaks
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Formula C20H19ClFN3O4S2
InChI InChI=1S/C20H19ClFN3O4S2/c1-3-14(12-18-16(21)9-11-30-18)24(17-8-10-23-20(22)19(17)25(26)27)31(28,29)15-6-4-13(2)5-7-15/h4-11,14H,3,12H2,1-2H3/t14-/m1/s1
InChIKey QDOMKIPUFYNFGC-CQSZACIVSA-N
Molecular Weight 483.960 g/mol
SMILES c1(N(S(c2ccc(cc2)C)(=O)=O)[C@@](Cc2c(ccs2)Cl)(CC)[H])c(N(=O)=O)c(F)ncc1
SPLASH splash10-03e9-0009900000-b54b47fa886fe7244b2c
Source of Spectrum J-65-8116-12
Synonyms N-[(2R)-1-(3-chloro-2-thiophenyl)butan-2-yl]-N-(2-fluoro-3-nitro-4-pyridinyl)-4-methylbenzenesulfonamide N-[(2R)-1-(3-chlorothiophen-2-yl)butan-2-yl]-N-(2-fluoro-3-nitropyridin-4-yl)-4-methylbenzenesulfonamide N-[(2R)-1-(3-chloranylthiophen-2-yl)butan-2-yl]-N-(2-fluoranyl-3-nitro-pyridin-4-yl)-4-methyl-benzenesulfonamide
Wiley ID 1533822