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2-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-{2-[(2-furylmethyl)sulfanyl]ethyl}acetamide
SpectraBase Compound ID 7fstMiMNG8C
InChI InChI=1S/C16H16N2O5S2/c19-15(17-7-9-24-11-12-4-3-8-23-12)10-18-16(20)13-5-1-2-6-14(13)25(18,21)22/h1-6,8H,7,9-11H2,(H,17,19)
InChIKey AEGKXBLYXZRJOF-UHFFFAOYSA-N
Mol Weight 380.43 g/mol
Molecular Formula C16H16N2O5S2
Exact Mass 380.050064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9giHmdac8UU
Name 2-(1,1-Dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-{2-[(2-furylmethyl)sulfanyl]ethyl}acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.050063966 u
Formula C16H16N2O5S2
InChI InChI=1S/C16H16N2O5S2/c19-15(17-7-9-24-11-12-4-3-8-23-12)10-18-16(20)13-5-1-2-6-14(13)25(18,21)22/h1-6,8H,7,9-11H2,(H,17,19)
InChIKey AEGKXBLYXZRJOF-UHFFFAOYSA-N
Molecular Weight 380.433 g/mol
SMILES N(C(CN1S(C=2C(=CC=CC2)C1=O)(=O)=O)=O)CCSCC=1OC=CC1