(5E)-1-sec-butyl-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	9INAtlOwYGm
InChI	InChI=1S/C15H21N5O2S/c1-3-11(2)20-14(22)12(13(21)18-15(20)23)9-16-5-4-7-19-8-6-17-10-19/h6,8-11,16H,3-5,7H2,1-2H3,(H,18,21,23)/b12-9+
InChIKey	VCPYPEKSZITYJJ-FMIVXFBMSA-N Google Search
Mol Weight	335.43 g/mol
Molecular Formula	C15H21N5O2S
Exact Mass	335.141596 g/mol

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SpectraBase Spectrum ID	J1zKVeOMJuE
Name	(5E)-1-sec-butyl-5-({[3-(1H-imidazol-1-yl)propyl]amino}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/C15H21N5O2S/c1-3-11(2)20-14(22)12(13(21)18-15(20)23)9-16-5-4-7-19-8-6-17-10-19/h6,8-11,16H,3-5,7H2,1-2H3,(H,18,21,23)/b12-9+
InChIKey	VCPYPEKSZITYJJ-FMIVXFBMSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_17648
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: D28858; Labnumber: KKA-0211-3813; SBI_ID: SBI-017651
Synonyms	1-sec-butyl-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	318 °C