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(5E)-5-({5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furyl}methylene)-3-(3-methylphenyl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one

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(5E)-5-({5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furyl}methylene)-3-(3-methylphenyl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
SpectraBase Compound ID 9WFLsXYSN7c
InChI InChI=1S/C19H14ClN5O4S/c1-11-3-2-4-12(7-11)24-18(26)16(21-19(24)30)8-13-5-6-14(29-13)9-23-10-15(20)17(22-23)25(27)28/h2-8,10H,9H2,1H3,(H,21,30)/b16-8+
InChIKey YMABOSFPCOISQF-LZYBPNLTSA-N
Mol Weight 443.87 g/mol
Molecular Formula C19H14ClN5O4S
Exact Mass 443.045503 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6oXenJjcNYI
Name (5E)-5-({5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furyl}methylene)-3-(3-methylphenyl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
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/C19H14ClN5O4S/c1-11-3-2-4-12(7-11)24-18(26)16(21-19(24)30)8-13-5-6-14(29-13)9-23-10-15(20)17(22-23)25(27)28/h2-8,10H,9H2,1H3,(H,21,30)/b16-8+
InChIKey YMABOSFPCOISQF-LZYBPNLTSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30026
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: 1552672; SBI_ID: SBI-030030
Synonyms 5-({5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furyl}methylene)-3-(3-methylphenyl)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Temperature 318 °C