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{3-[(Z)-(6-(anilinocarbonyl)-7-methyl-3-oxo-5-(2-thienyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenoxy}acetic acid
SpectraBase Compound ID 2RjUKnC8uWJ
InChI InChI=1S/C27H21N3O5S2/c1-16-23(25(33)29-18-8-3-2-4-9-18)24(20-11-6-12-36-20)30-26(34)21(37-27(30)28-16)14-17-7-5-10-19(13-17)35-15-22(31)32/h2-14,24H,15H2,1H3,(H,29,33)(H,31,32)/b21-14-
InChIKey DLTJGCZSULHUOT-STZFKDTASA-N
Mol Weight 531.6 g/mol
Molecular Formula C27H21N3O5S2
Exact Mass 531.092263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JHExnfI3D5l
Name {3-[(Z)-(6-(anilinocarbonyl)-7-methyl-3-oxo-5-(2-thienyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenoxy}acetic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H21N3O5S2/c1-16-23(25(33)29-18-8-3-2-4-9-18)24(20-11-6-12-36-20)30-26(34)21(37-27(30)28-16)14-17-7-5-10-19(13-17)35-15-22(31)32/h2-14,24H,15H2,1H3,(H,29,33)(H,31,32)/b21-14-
InChIKey DLTJGCZSULHUOT-STZFKDTASA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6225
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: 62693; UBI_ID: UBI-006227
Synonyms {3-[(6-(anilinocarbonyl)-7-methyl-3-oxo-5-(2-thienyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenoxy}acetic acid
Temperature 308 °C