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5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide, 3-amino-N-[4-[[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl]phenyl]-6,7,8,9-tetrahydro-
SpectraBase Compound ID 4AgEUiinEmw
InChI InChI=1S/C25H26N6O3S2/c1-14-12-15(2)28-25(27-14)31-36(33,34)18-10-8-17(9-11-18)29-23(32)22-21(26)19-13-16-6-4-3-5-7-20(16)30-24(19)35-22/h8-13H,3-7,26H2,1-2H3,(H,29,32)(H,27,28,31)
InChIKey LQBXOXIMHZRTRV-UHFFFAOYSA-N
Mol Weight 522.64 g/mol
Molecular Formula C25H26N6O3S2
Exact Mass 522.150781 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IpYB8ibPqvM
Name 5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide, 3-amino-N-[4-[[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl]phenyl]-6,7,8,9-tetrahydro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.150781066 u
Formula C25H26N6O3S2
InChI InChI=1S/C25H26N6O3S2/c1-14-12-15(2)28-25(27-14)31-36(33,34)18-10-8-17(9-11-18)29-23(32)22-21(26)19-13-16-6-4-3-5-7-20(16)30-24(19)35-22/h8-13H,3-7,26H2,1-2H3,(H,29,32)(H,27,28,31)
InChIKey LQBXOXIMHZRTRV-UHFFFAOYSA-N
Molecular Weight 522.642 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15651
Solvent DMSO-d6
Source Vendor ID: NMR/10252955; Lab Info: NKS; Lab Number: NKS-0501324