(5E)-1-cyclohexyl-5-({[3-(2-furyl)-3-(4-methylphenyl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	GhOSdEz0y8y
InChI	InChI=1S/C25H29N3O3S/c1-17-9-11-18(12-10-17)20(22-8-5-15-31-22)13-14-26-16-21-23(29)27-25(32)28(24(21)30)19-6-3-2-4-7-19/h5,8-12,15-16,19-20,26H,2-4,6-7,13-14H2,1H3,(H,27,29,32)/b21-16+
InChIKey	MMAQPGHSTRHRQU-LTGZKZEYSA-N Google Search
Mol Weight	451.59 g/mol
Molecular Formula	C25H29N3O3S
Exact Mass	451.192963 g/mol

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SpectraBase Spectrum ID	62MCK0RR2Yw
Name	(5E)-1-cyclohexyl-5-({[3-(2-furyl)-3-(4-methylphenyl)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/C25H29N3O3S/c1-17-9-11-18(12-10-17)20(22-8-5-15-31-22)13-14-26-16-21-23(29)27-25(32)28(24(21)30)19-6-3-2-4-7-19/h5,8-12,15-16,19-20,26H,2-4,6-7,13-14H2,1H3,(H,27,29,32)/b21-16+
InChIKey	MMAQPGHSTRHRQU-LTGZKZEYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13602
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: D86314; Labnumber: KV-2545; SBI_ID: SBI-013605
Synonyms	1-cyclohexyl-5-({[3-(2-furyl)-3-(4-methylphenyl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	308 °C