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4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[2-[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl]thio]-3,5,6,7-tetrahydro-3-(2-propenyl)-

View entire compound with spectra: 1 NMR

4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[2-[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl]thio]-3,5,6,7-tetrahydro-3-(2-propenyl)-
SpectraBase Compound ID 9aQPOJaREmF
InChI InChI=1S/C26H24ClN3O2S2/c1-4-12-29-25(32)23-19-6-5-7-22(19)34-24(23)28-26(29)33-14-21(31)20-13-15(2)30(16(20)3)18-10-8-17(27)9-11-18/h4,8-11,13H,1,5-7,12,14H2,2-3H3
InChIKey KAFOVCXDAIAZNU-UHFFFAOYSA-N
Mol Weight 510.07 g/mol
Molecular Formula C26H24ClN3O2S2
Exact Mass 509.099847 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BybcS0YU6Il
Name 4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[2-[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl]thio]-3,5,6,7-tetrahydro-3-(2-propenyl)-
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/C26H24ClN3O2S2/c1-4-12-29-25(32)23-19-6-5-7-22(19)34-24(23)28-26(29)33-14-21(31)20-13-15(2)30(16(20)3)18-10-8-17(27)9-11-18/h4,8-11,13H,1,5-7,12,14H2,2-3H3
InChIKey KAFOVCXDAIAZNU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_856
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: NMR/11228544