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(5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-[(1-methyl-1H-indol-3-yl)methylene]-1,3-thiazol-4(5H)-one
SpectraBase Compound ID CWWZCkaBJdU
InChI InChI=1S/C20H13ClF3N3OS/c1-27-10-11(13-4-2-3-5-16(13)27)8-17-18(28)26-19(29-17)25-15-7-6-12(21)9-14(15)20(22,23)24/h2-10H,1H3,(H,25,26,28)/b17-8-
InChIKey QAEOOFFUBDWXLJ-IUXPMGMMSA-N
Mol Weight 435.85 g/mol
Molecular Formula C20H13ClF3N3OS
Exact Mass 435.041995 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C7b7qE5wsNZ
Name (2E,5Z)-2-{[4-chloro-2-(trifluoromethyl)phenyl]imino}-5-[(1-methyl-1H-indol-3-yl)methylene]-1,3-thiazolidin-4-one
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/C20H13ClF3N3OS/c1-27-10-11(13-4-2-3-5-16(13)27)8-17-18(28)26-19(29-17)25-15-7-6-12(21)9-14(15)20(22,23)24/h2-10H,1H3,(H,25,26,28)/b17-8-
InChIKey QAEOOFFUBDWXLJ-IUXPMGMMSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10976
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: E04009; Labnumber: GORPS-113-4937; SBI_ID: SBI-010979
Synonyms 2-{[4-chloro-2-(trifluoromethyl)phenyl]imino}-5-[(1-methyl-1H-indol-3-yl)methylene]-1,3-thiazolidin-4-one
Temperature 308 °C