(5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-[(isobutylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	3eIMdaQUhma
InChI	InChI=1S/C17H25N3O2S/c1-12(2)10-18-11-14-15(21)19-17(23)20(16(14)22)9-8-13-6-4-3-5-7-13/h6,11-12,18H,3-5,7-10H2,1-2H3,(H,19,21,23)/b14-11+
InChIKey	HDARWDRWTSKMIZ-SDNWHVSQSA-N Google Search
Mol Weight	335.47 g/mol
Molecular Formula	C17H25N3O2S
Exact Mass	335.166748 g/mol

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SpectraBase Spectrum ID	9n3qlApMGem
Name	(5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-[(isobutylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C17H25N3O2S/c1-12(2)10-18-11-14-15(21)19-17(23)20(16(14)22)9-8-13-6-4-3-5-7-13/h6,11-12,18H,3-5,7-10H2,1-2H3,(H,19,21,23)/b14-11+
InChIKey	HDARWDRWTSKMIZ-SDNWHVSQSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13604
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: D86318; Labnumber: KV-2549; SBI_ID: SBI-013607
Synonyms	1-[2-(1-cyclohexen-1-yl)ethyl]-5-[(isobutylamino)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C