N-(4,6-dimethyl-2-pyrimidinyl)-N'-(3-nitrophenyl)-N''-[(E)-oxo(10H-phenothiazin-10-yl)methyl]guanidine

SpectraBase Compound ID	6LL64RC8CbZ
InChI	InChI=1S/C26H21N7O3S/c1-16-14-17(2)28-24(27-16)30-25(29-18-8-7-9-19(15-18)33(35)36)31-26(34)32-20-10-3-5-12-22(20)37-23-13-6-4-11-21(23)32/h3-15H,1-2H3,(H2,27,28,29,30,31,34)
InChIKey	SQOLEEWNZSMGAF-UHFFFAOYSA-N Google Search
Mol Weight	511.56 g/mol
Molecular Formula	C26H21N7O3S
Exact Mass	511.142659 g/mol

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SpectraBase Spectrum ID	It01GI4vq8X
Name	guanidine, N-(4,6-dimethyl-2-pyrimidinyl)-N'-(3-nitrophenyl)-N''-[(Z)-oxo-10H-phenothiazin-10-ylmethyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	511.142658735 u
Formula	C26H21N7O3S
InChI	InChI=1S/C26H21N7O3S/c1-16-14-17(2)28-24(27-16)30-25(29-18-8-7-9-19(15-18)33(35)36)31-26(34)32-20-10-3-5-12-22(20)37-23-13-6-4-11-21(23)32/h3-15H,1-2H3,(H2,27,28,29,30,31,34)
InChIKey	SQOLEEWNZSMGAF-UHFFFAOYSA-N
Molecular Weight	511.560 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_17010
Solvent	DMSO-d6
Source	Vendor ID: ZI/10054809; Lab Info: VGY; Lab Number: VGY-0013593