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1,1-DIMETHYLETHYL-5-[(2-THIONO-1,3-THIAZOLIDIN-3-YL)-CARBONYL]-1H-BENZIMIDAZOLE-1-CARBOXYLATE
SpectraBase Compound ID 46UEMKBdESN
InChI InChI=1S/2C16H17N3O3S2/c2*1-16(2,3)22-14(21)19-9-17-11-8-10(4-5-12(11)19)13(20)18-6-7-24-15(18)23/h2*4-5,8-9H,6-7H2,1-3H3
InChIKey WGTOULHGZLKYIN-UHFFFAOYSA-N
Mol Weight 726.9 g/mol
Molecular Formula C32H34N6O6S4
Exact Mass 726.142268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1C3uw6uSHpz
Name 1,1-DIMETHYLETHYL-5-[(2-THIONO-1,3-THIAZOLIDIN-3-YL)-CARBONYL]-1H-BENZIMIDAZOLE-1-CARBOXYLATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H34N6O6S4
InChI InChI=1S/2C16H17N3O3S2/c2*1-16(2,3)22-14(21)19-9-17-11-8-10(4-5-12(11)19)13(20)18-6-7-24-15(18)23/h2*4-5,8-9H,6-7H2,1-3H3
InChIKey WGTOULHGZLKYIN-UHFFFAOYSA-N
Literature Reference Author Z.ZHANG,P.CHALTIN,A.V.AERSCHOT,J.LACEY,J.ROZENSKI,R.BUSSON,P .HERDEWIJN
Literature Reference Citation BIOORG.MED.CHEM.,10,3401(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00268-7
Molecular Weight 726.899 g/mol
Solvent CDCl3
Source File Reference UWSI24333