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ethanone, 2-[[4-amino-5,6,7,8-tetrahydro-7-(phenylmethyl)pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]thio]-1-phenyl-
SpectraBase Compound ID AOqa4l57rrm
InChI InChI=1S/C24H22N4OS2/c25-22-21-18-11-12-28(13-16-7-3-1-4-8-16)14-20(18)31-23(21)27-24(26-22)30-15-19(29)17-9-5-2-6-10-17/h1-10H,11-15H2,(H2,25,26,27)
InChIKey BJQBEAKKCSBHER-UHFFFAOYSA-N
Mol Weight 446.59 g/mol
Molecular Formula C24H22N4OS2
Exact Mass 446.123504 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JcnIwsQRQiD
Name ethanone, 2-[[4-amino-5,6,7,8-tetrahydro-7-(phenylmethyl)pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]thio]-1-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.123503691 u
Formula C24H22N4OS2
InChI InChI=1S/C24H22N4OS2/c25-22-21-18-11-12-28(13-16-7-3-1-4-8-16)14-20(18)31-23(21)27-24(26-22)30-15-19(29)17-9-5-2-6-10-17/h1-10H,11-15H2,(H2,25,26,27)
InChIKey BJQBEAKKCSBHER-UHFFFAOYSA-N
Molecular Weight 446.587 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1373
Solvent DMSO-d6
Source Vendor ID: ZI/7131647; Lab Info: XX; Lab Number: AJ-292/11386001
Temperature 29.85 °C