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4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5,6-dihydro-, ethyl ester

View entire compound with spectra: 1 NMR

4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5,6-dihydro-, ethyl ester
SpectraBase Compound ID ECm6LgBpyWH
InChI InChI=1S/C20H21N3O3S3/c1-4-26-20(25)16-12-6-5-7-13(12)29-19(16)23-14(24)8-27-17-15-10(2)11(3)28-18(15)22-9-21-17/h9H,4-8H2,1-3H3,(H,23,24)
InChIKey WCHXDUDTBAWQCO-UHFFFAOYSA-N
Mol Weight 447.59 g/mol
Molecular Formula C20H21N3O3S3
Exact Mass 447.074505 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3wx6BtPovTW
Name 4H-cyclopenta[b]thiophene-3-carboxylic acid, 2-[[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]-5,6-dihydro-, ethyl ester
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/C20H21N3O3S3/c1-4-26-20(25)16-12-6-5-7-13(12)29-19(16)23-14(24)8-27-17-15-10(2)11(3)28-18(15)22-9-21-17/h9H,4-8H2,1-3H3,(H,23,24)
InChIKey WCHXDUDTBAWQCO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_978
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/11228691