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ethyl 2-({[(1-allyl-6-amino-4-oxo-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

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ethyl 2-({[(1-allyl-6-amino-4-oxo-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID FYHJsnm0bfc
InChI InChI=1S/C19H22N4O4S2/c1-3-8-23-13(20)9-14(24)22-19(23)28-10-15(25)21-17-16(18(26)27-4-2)11-6-5-7-12(11)29-17/h3,9H,1,4-8,10,20H2,2H3,(H,21,25)
InChIKey GOPFLQYDVVYTSX-UHFFFAOYSA-N
Mol Weight 434.53 g/mol
Molecular Formula C19H22N4O4S2
Exact Mass 434.108248 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EMjpYO18KKh
Name ethyl 2-({[(1-allyl-6-amino-4-oxo-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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/C19H22N4O4S2/c1-3-8-23-13(20)9-14(24)22-19(23)28-10-15(25)21-17-16(18(26)27-4-2)11-6-5-7-12(11)29-17/h3,9H,1,4-8,10,20H2,2H3,(H,21,25)
InChIKey GOPFLQYDVVYTSX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11177
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: 1003442; UBI_ID: UBI-011180
Temperature 308 °C