(4E)-2-(1,3-benzothiazol-2-yl)-4-[(4-morpholinylamino)methylene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one compound with N,N-dimethylamine (1:1)

SpectraBase Compound ID	7qPt5f10Wf8
InChI	InChI=1S/C16H14F3N5O2S.C2H7N/c17-16(18,19)13-10(9-20-23-5-7-26-8-6-23)14(25)24(22-13)15-21-11-3-1-2-4-12(11)27-15;1-3-2/h1-4,9,20H,5-8H2;3H,1-2H3/b10-9+;
InChIKey	ONTJMVFZKQMJFI-RRABGKBLSA-N Google Search
Mol Weight	442.46 g/mol
Molecular Formula	C18H21F3N6O2S
Exact Mass	442.13988 g/mol

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SpectraBase Spectrum ID	ZE4WZv7eGr
Name	(4E)-2-(1,3-benzothiazol-2-yl)-4-[(4-morpholinylamino)methylene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one compound with N,N-dimethylamine (1:1)
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/C16H14F3N5O2S.C2H7N/c17-16(18,19)13-10(9-20-23-5-7-26-8-6-23)14(25)24(22-13)15-21-11-3-1-2-4-12(11)27-15;1-3-2/h1-4,9,20H,5-8H2;3H,1-2H3/b10-9+;
InChIKey	ONTJMVFZKQMJFI-RRABGKBLSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_17725
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: UZI/9067887; UBI_ID: UBI-017728
Synonyms	2-(1,3-benzothiazol-2-yl)-4-[(4-morpholinylamino)methylene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one compound with N,N-dimethylamine (1:1)
Temperature	308 °C