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(5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-isopropylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

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(5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-isopropylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID AT74C0ZbSb5
InChI InChI=1S/C27H27N3O2S/c1-16(2)20-8-12-23(13-9-20)30-26(32)24(25(31)28-27(30)33)15-21-14-18(4)29(19(21)5)22-10-6-17(3)7-11-22/h6-16H,1-5H3,(H,28,31,33)/b24-15-
InChIKey AWAZCGHNACTTLU-IWIPYMOSSA-N
Mol Weight 457.59 g/mol
Molecular Formula C27H27N3O2S
Exact Mass 457.182398 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Sag9RzVrwn
Name (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-isopropylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H27N3O2S/c1-16(2)20-8-12-23(13-9-20)30-26(32)24(25(31)28-27(30)33)15-21-14-18(4)29(19(21)5)22-10-6-17(3)7-11-22/h6-16H,1-5H3,(H,28,31,33)/b24-15-
InChIKey AWAZCGHNACTTLU-IWIPYMOSSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13927
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D91090; Labnumber: KKA-0212B-0588; SBI_ID: SBI-013930
Synonyms 5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-isopropylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 308 °C