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benzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-[[2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-2-oxoethyl]thio]-5,6,7,8-tetrahydro-3-(2-propenyl)-
SpectraBase Compound ID KuT3RYN743v
InChI InChI=1S/C27H27N3O2S2/c1-4-14-29-26(32)24-20-12-8-9-13-23(20)34-25(24)28-27(29)33-16-22(31)21-15-17(2)30(18(21)3)19-10-6-5-7-11-19/h4-7,10-11,15H,1,8-9,12-14,16H2,2-3H3
InChIKey VBEBMYBDXJQPTB-UHFFFAOYSA-N
Mol Weight 489.65 g/mol
Molecular Formula C27H27N3O2S2
Exact Mass 489.154469 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AWIWTkmiyEQ
Name benzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-[[2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-2-oxoethyl]thio]-5,6,7,8-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/C27H27N3O2S2/c1-4-14-29-26(32)24-20-12-8-9-13-23(20)34-25(24)28-27(29)33-16-22(31)21-15-17(2)30(18(21)3)19-10-6-5-7-11-19/h4-7,10-11,15H,1,8-9,12-14,16H2,2-3H3
InChIKey VBEBMYBDXJQPTB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_964
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/11228676