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ethyl (2Z)-2-(3-methoxy-4-methylbenzylidene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID KJtKqJmzFJR
InChI InChI=1S/C26H26N2O4S2/c1-6-32-25(30)22-16(3)27-26-28(23(22)18-9-11-19(33-5)12-10-18)24(29)21(34-26)14-17-8-7-15(2)20(13-17)31-4/h7-14,23H,6H2,1-5H3/b21-14-
InChIKey PXDINKREOZIIAX-STZFKDTASA-N
Mol Weight 494.62 g/mol
Molecular Formula C26H26N2O4S2
Exact Mass 494.1334 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IJCGZFOPojm
Name ethyl (2Z)-2-(3-methoxy-4-methylbenzylidene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-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/C26H26N2O4S2/c1-6-32-25(30)22-16(3)27-26-28(23(22)18-9-11-19(33-5)12-10-18)24(29)21(34-26)14-17-8-7-15(2)20(13-17)31-4/h7-14,23H,6H2,1-5H3/b21-14-
InChIKey PXDINKREOZIIAX-STZFKDTASA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5136
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: 9676475; UBI_ID: UBI-005138
Synonyms ethyl 2-(3-methoxy-4-methylbenzylidene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Temperature 308 °C