(5E)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-phenyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	E45XHNGwl6E
InChI	InChI=1S/C23H25N3O2S/c1-15-13-17(16(2)25(15)18-9-5-3-6-10-18)14-20-21(27)24-23(29)26(22(20)28)19-11-7-4-8-12-19/h4,7-8,11-14,18H,3,5-6,9-10H2,1-2H3,(H,24,27,29)/b20-14+
InChIKey	MLIQZRDQXODBTL-XSFVSMFZSA-N Google Search
Mol Weight	407.53 g/mol
Molecular Formula	C23H25N3O2S
Exact Mass	407.166748 g/mol

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SpectraBase Spectrum ID	1D0YvZQ95VZ
Name	(5E)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-phenyl-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/C23H25N3O2S/c1-15-13-17(16(2)25(15)18-9-5-3-6-10-18)14-20-21(27)24-23(29)26(22(20)28)19-11-7-4-8-12-19/h4,7-8,11-14,18H,3,5-6,9-10H2,1-2H3,(H,24,27,29)/b20-14+
InChIKey	MLIQZRDQXODBTL-XSFVSMFZSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9685
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: 133714; Labnumber: AREF2K-3208; VK_ID: VK-009689
Synonyms	5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-phenyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	315 °C