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acetamide, 2-[(5-cyano-1,6-dihydro-6-oxo-4-phenyl-2-pyrimidinyl)thio]-N-(4-methoxyphenyl)-
SpectraBase Compound ID AwwAiEe2Y0F
InChI InChI=1S/C20H16N4O3S/c1-27-15-9-7-14(8-10-15)22-17(25)12-28-20-23-18(13-5-3-2-4-6-13)16(11-21)19(26)24-20/h2-10H,12H2,1H3,(H,22,25)(H,23,24,26)
InChIKey NGODTEODFLDQHP-UHFFFAOYSA-N
Mol Weight 392.43 g/mol
Molecular Formula C20H16N4O3S
Exact Mass 392.094312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KMMG3tXqeR3
Name acetamide, 2-[(5-cyano-1,6-dihydro-6-oxo-4-phenyl-2-pyrimidinyl)thio]-N-(4-methoxyphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.094311562 u
Formula C20H16N4O3S
InChI InChI=1S/C20H16N4O3S/c1-27-15-9-7-14(8-10-15)22-17(25)12-28-20-23-18(13-5-3-2-4-6-13)16(11-21)19(26)24-20/h2-10H,12H2,1H3,(H,22,25)(H,23,24,26)
InChIKey NGODTEODFLDQHP-UHFFFAOYSA-N
Molecular Weight 392.433 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12979
Solvent DMSO-d6
Source Vendor ID: NMR/10291447; Lab Info: SAD; Lab Number: SAD-0102409