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4-methoxy-N-(4-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)benzenesulfonamide
SpectraBase Compound ID K8NOzgMghto
InChI InChI=1S/C18H22N2O6S2/c1-25-15-6-10-18(11-7-15)28(23,24)20-14-4-8-17(9-5-14)27(21,22)19-13-16-3-2-12-26-16/h4-11,16,19-20H,2-3,12-13H2,1H3
InChIKey AWRANEIZIBPLPR-UHFFFAOYSA-N
Mol Weight 426.5 g/mol
Molecular Formula C18H22N2O6S2
Exact Mass 426.091929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9faKlKSP7lB
Name 4-Methoxy-N-(4-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)benzenesulfonamide
Comments Computed using HOSE algorithm
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Exact Mass 426.091928778 u
Formula C18H22N2O6S2
InChI InChI=1S/C18H22N2O6S2/c1-25-15-6-10-18(11-7-15)28(23,24)20-14-4-8-17(9-5-14)27(21,22)19-13-16-3-2-12-26-16/h4-11,16,19-20H,2-3,12-13H2,1H3
InChIKey AWRANEIZIBPLPR-UHFFFAOYSA-N
Molecular Weight 426.502 g/mol
SMILES N(S(C=1C=CC(NS(C2=CC=C(C=C2)OC)(=O)=O)=CC1)(=O)=O)CC1OCCC1