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9-{[4-(3-chlorophenyl)-1-piperazinyl]carbonyl}-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
SpectraBase Compound ID HqHIaSNCnzI
InChI InChI=1S/C25H23ClN4O2S/c26-17-4-3-5-18(14-17)28-10-12-29(13-11-28)24(31)16-8-9-21-27-23-22(25(32)30(21)15-16)19-6-1-2-7-20(19)33-23/h3-5,8-9,14-15H,1-2,6-7,10-13H2
InChIKey UNCKHWAOROJKPE-UHFFFAOYSA-N
Mol Weight 479.0 g/mol
Molecular Formula C25H23ClN4O2S
Exact Mass 478.123025 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FUoPS8ip7M8
Name 9-{[4-(3-chlorophenyl)-1-piperazinyl]carbonyl}-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidin-12-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.123024869 u
Formula C25H23ClN4O2S
InChI InChI=1S/C25H23ClN4O2S/c26-17-4-3-5-18(14-17)28-10-12-29(13-11-28)24(31)16-8-9-21-27-23-22(25(32)30(21)15-16)19-6-1-2-7-20(19)33-23/h3-5,8-9,14-15H,1-2,6-7,10-13H2
InChIKey UNCKHWAOROJKPE-UHFFFAOYSA-N
Molecular Weight 478.998 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6904
Solvent DMSO-d6
Source Vendor ID: NMR/12329347