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ethyl (2Z)-5-(4-fluorophenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID KGIMJLK7Qcd
InChI InChI=1S/C26H27FN4O4S/c1-4-34-25(33)22-16(2)28-26-31(23(22)17-5-7-18(27)8-6-17)24(32)20(36-26)15-19-9-10-21(35-19)30-13-11-29(3)12-14-30/h5-10,15,23H,4,11-14H2,1-3H3/b20-15-
InChIKey YAKACQBIFZKQDQ-HKWRFOASSA-N
Mol Weight 510.58 g/mol
Molecular Formula C26H27FN4O4S
Exact Mass 510.173705 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bxzb09Vh3z9
Name ethyl (2Z)-5-(4-fluorophenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-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/C26H27FN4O4S/c1-4-34-25(33)22-16(2)28-26-31(23(22)17-5-7-18(27)8-6-17)24(32)20(36-26)15-19-9-10-21(35-19)30-13-11-29(3)12-14-30/h5-10,15,23H,4,11-14H2,1-3H3/b20-15-
InChIKey YAKACQBIFZKQDQ-HKWRFOASSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15643
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: C75005; Labnumber: SPDEM-1150; SBI_ID: SBI-015646
Synonyms ethyl 5-(4-fluorophenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 318 °C