(5Z)-5-[(hexylamino)methylene]-1-(1-naphthyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	Gdcztxr1y0a
InChI	InChI=1S/C21H23N3O2S/c1-2-3-4-7-13-22-14-17-19(25)23-21(27)24(20(17)26)18-12-8-10-15-9-5-6-11-16(15)18/h5-6,8-12,14,22H,2-4,7,13H2,1H3,(H,23,25,27)/b17-14-
InChIKey	FKOKVOSXLMGERG-VKAVYKQESA-N Google Search
Mol Weight	381.49 g/mol
Molecular Formula	C21H23N3O2S
Exact Mass	381.151098 g/mol

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SpectraBase Spectrum ID	9rz80XTYNKK
Name	(5Z)-5-[(hexylamino)methylene]-1-(1-naphthyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H23N3O2S/c1-2-3-4-7-13-22-14-17-19(25)23-21(27)24(20(17)26)18-12-8-10-15-9-5-6-11-16(15)18/h5-6,8-12,14,22H,2-4,7,13H2,1H3,(H,23,25,27)/b17-14-
InChIKey	FKOKVOSXLMGERG-VKAVYKQESA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_27603
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: D77217; Labnumber: KKA-0212C-0952; SBI_ID: SBI-027607
Synonyms	5-[(hexylamino)methylene]-1-(1-naphthyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C