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acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2-[[5,6,7,8-tetrahydro-2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxopyrimido[4,5-d]pyrimidin-4-yl]thio]-
SpectraBase Compound ID EiWgM47hwlZ
InChI InChI=1S/C25H23N5O6S/c1-29-22-20(24(32)30(2)25(29)33)23(28-21(27-22)15-5-7-16(34-3)8-6-15)37-12-19(31)26-11-14-4-9-17-18(10-14)36-13-35-17/h4-10H,11-13H2,1-3H3,(H,26,31)
InChIKey MVNFCXCTQSISJH-UHFFFAOYSA-N
Mol Weight 521.55 g/mol
Molecular Formula C25H23N5O6S
Exact Mass 521.136905 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7qrOdZENKgV
Name acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2-[[5,6,7,8-tetrahydro-2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxopyrimido[4,5-d]pyrimidin-4-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 521.136904649 u
Formula C25H23N5O6S
InChI InChI=1S/C25H23N5O6S/c1-29-22-20(24(32)30(2)25(29)33)23(28-21(27-22)15-5-7-16(34-3)8-6-15)37-12-19(31)26-11-14-4-9-17-18(10-14)36-13-35-17/h4-10H,11-13H2,1-3H3,(H,26,31)
InChIKey MVNFCXCTQSISJH-UHFFFAOYSA-N
Molecular Weight 521.548 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3782
Solvent DMSO-d6
Source Vendor ID: NMR/13279070