(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}tetrahydro-2H-1,3-thiazine-6-carboxamide

SpectraBase Compound ID	8fsfhoU2THr
InChI	InChI=1S/C26H19BrF3N3O4S/c27-17-4-2-6-19(11-17)31-24(35)22-12-23(34)33(13-15-7-8-20-21(9-15)37-14-36-20)25(38-22)32-18-5-1-3-16(10-18)26(28,29)30/h1-11,22H,12-14H2,(H,31,35)/b32-25-
InChIKey	NKTRQDOTYLTLPR-MKCFTUBBSA-N Google Search
Mol Weight	606.41 g/mol
Molecular Formula	C26H19BrF3N3O4S
Exact Mass	605.023175 g/mol

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SpectraBase Spectrum ID	8NdmJCFiLCf
Name	(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}tetrahydro-2H-1,3-thiazine-6-carboxamide
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/C26H19BrF3N3O4S/c27-17-4-2-6-19(11-17)31-24(35)22-12-23(34)33(13-15-7-8-20-21(9-15)37-14-36-20)25(38-22)32-18-5-1-3-16(10-18)26(28,29)30/h1-11,22H,12-14H2,(H,31,35)/b32-25-
InChIKey	NKTRQDOTYLTLPR-MKCFTUBBSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_7485
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: D29908; Labnumber: MPOL-13376; SBI_ID: SBI-007488
Synonyms	3-(1,3-benzodioxol-5-ylmethyl)-N-(3-bromophenyl)-4-oxo-2-{[3-(trifluoromethyl)phenyl]imino}tetrahydro-2H-1,3-thiazine-6-carboxamide
Temperature	308 °C