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3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide, 2-(5-chloro-2-thienyl)-N-(2-methoxyphenyl)-8-methyl-9-oxo-
SpectraBase Compound ID JU4xCAi9USt
InChI InChI=1S/C21H15ClN4O3S3/c1-10-16-19(32-17(10)18(27)23-11-5-3-4-6-13(11)29-2)24-21-26(20(16)28)25-12(9-30-21)14-7-8-15(22)31-14/h3-8H,9H2,1-2H3,(H,23,27)
InChIKey LNJVIKPOYQPTSA-UHFFFAOYSA-N
Mol Weight 503.01 g/mol
Molecular Formula C21H15ClN4O3S3
Exact Mass 501.999482 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AVqTtUvHtMR
Name 3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide, 2-(5-chloro-2-thienyl)-N-(2-methoxyphenyl)-8-methyl-9-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 501.999481578 u
Formula C21H15ClN4O3S3
InChI InChI=1S/C21H15ClN4O3S3/c1-10-16-19(32-17(10)18(27)23-11-5-3-4-6-13(11)29-2)24-21-26(20(16)28)25-12(9-30-21)14-7-8-15(22)31-14/h3-8H,9H2,1-2H3,(H,23,27)
InChIKey LNJVIKPOYQPTSA-UHFFFAOYSA-N
Molecular Weight 503.009 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6512
Solvent DMSO-d6
Source Vendor ID: NMR/13289753