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3-{4-[4-(HYDRAZINO-CARBONYLAMINO)-PHENYL]-PIPERAZIN-1-YL}-6-METHOXY-BENZO-[B]-THIOPHENE
SpectraBase Compound ID KhHwIghWxkg
InChI InChI=1S/C20H23N5O2S/c1-27-16-6-7-17-18(13-28-19(17)12-16)25-10-8-24(9-11-25)15-4-2-14(3-5-15)22-20(26)23-21/h2-7,12-13H,8-11,21H2,1H3,(H2,22,23,26)
InChIKey KUFGNPWYDMXGRB-UHFFFAOYSA-N
Mol Weight 397.5 g/mol
Molecular Formula C20H23N5O2S
Exact Mass 397.157246 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IYqHw39hTit
Name 3-{4-[4-(HYDRAZINO-CARBONYLAMINO)-PHENYL]-PIPERAZIN-1-YL}-6-METHOXY-BENZO-[B]-THIOPHENE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H23N5O2S
InChI InChI=1S/C20H23N5O2S/c1-27-16-6-7-17-18(13-28-19(17)12-16)25-10-8-24(9-11-25)15-4-2-14(3-5-15)22-20(26)23-21/h2-7,12-13H,8-11,21H2,1H3,(H2,22,23,26)
InChIKey KUFGNPWYDMXGRB-UHFFFAOYSA-N
Literature Reference Author J.BOLOS,S.GUBERT,L.ANGLADA,A.SACRISTAN,J.A.ORTIZ
Literature Reference Citation J.HETCYCL.CHEM.,34,1709(1997)
Literature Reference DOI 10.1002/jhet.5570340611
Molecular Weight 397.495 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWSW497