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N-{3-[(dimethylamino)sulfonyl]phenyl}-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetamide
SpectraBase Compound ID 8K8J5nckOXS
InChI InChI=1S/C18H17N5O3S3/c1-22(2)29(25,26)13-7-5-6-12(10-13)19-16(24)11-27-17-20-21-18-23(17)14-8-3-4-9-15(14)28-18/h3-10H,11H2,1-2H3,(H,19,24)
InChIKey PSKCNGBEPMUTMF-UHFFFAOYSA-N
Mol Weight 447.55 g/mol
Molecular Formula C18H17N5O3S3
Exact Mass 447.049353 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HaTBENGnZbk
Name N-{3-[(dimethylamino)sulfonyl]phenyl}-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.049352946 u
Formula C18H17N5O3S3
InChI InChI=1S/C18H17N5O3S3/c1-22(2)29(25,26)13-7-5-6-12(10-13)19-16(24)11-27-17-20-21-18-23(17)14-8-3-4-9-15(14)28-18/h3-10H,11H2,1-2H3,(H,19,24)
InChIKey PSKCNGBEPMUTMF-UHFFFAOYSA-N
Molecular Weight 447.546 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5639
Solvent DMSO-d6
Source Vendor ID: NMR/12318881
Temperature 29.85 °C