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propanamide, N-[2-[[2-oxo-2-(phenylamino)ethyl]thio]-6-benzothiazolyl]-2-[(1-phenyl-1H-tetrazol-5-yl)thio]-
SpectraBase Compound ID 6HQ6mo7hLfu
InChI InChI=1S/C25H21N7O2S3/c1-16(36-24-29-30-31-32(24)19-10-6-3-7-11-19)23(34)27-18-12-13-20-21(14-18)37-25(28-20)35-15-22(33)26-17-8-4-2-5-9-17/h2-14,16H,15H2,1H3,(H,26,33)(H,27,34)
InChIKey TUVUBIGYFSAXHB-UHFFFAOYSA-N
Mol Weight 547.67 g/mol
Molecular Formula C25H21N7O2S3
Exact Mass 547.091886 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6F0OBXHxjSt
Name propanamide, N-[2-[[2-oxo-2-(phenylamino)ethyl]thio]-6-benzothiazolyl]-2-[(1-phenyl-1H-tetrazol-5-yl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 547.091886464 u
Formula C25H21N7O2S3
InChI InChI=1S/C25H21N7O2S3/c1-16(36-24-29-30-31-32(24)19-10-6-3-7-11-19)23(34)27-18-12-13-20-21(14-18)37-25(28-20)35-15-22(33)26-17-8-4-2-5-9-17/h2-14,16H,15H2,1H3,(H,26,33)(H,27,34)
InChIKey TUVUBIGYFSAXHB-UHFFFAOYSA-N
Molecular Weight 547.670 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9921
Solvent DMSO-d6
Source Vendor ID: NMR/9253646; Lab Info: LP; Lab Number: LP-0607103