N-(4-methoxyphenyl)-N'-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydro-2-pyrimidinyl)-N''-[(Z)-oxo(phenyl)methyl]guanidine

SpectraBase Compound ID	5mb4AyeehXK
InChI	InChI=1S/C27H25N5O3S/c1-18-8-14-23(15-9-18)36-17-21-16-24(33)30-26(29-21)32-27(28-20-10-12-22(35-2)13-11-20)31-25(34)19-6-4-3-5-7-19/h3-16H,17H2,1-2H3,(H3,28,29,30,31,32,33,34)
InChIKey	YVQWNADGSRXNKC-UHFFFAOYSA-N Google Search
Mol Weight	499.59 g/mol
Molecular Formula	C27H25N5O3S
Exact Mass	499.167811 g/mol

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SpectraBase Spectrum ID	3tS6aL08aOd
Name	N-(4-methoxyphenyl)-N'-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydro-2-pyrimidinyl)-N''-[(Z)-oxo(phenyl)methyl]guanidine
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/C27H25N5O3S/c1-18-8-14-23(15-9-18)36-17-21-16-24(33)30-26(29-21)32-27(28-20-10-12-22(35-2)13-11-20)31-25(34)19-6-4-3-5-7-19/h3-16H,17H2,1-2H3,(H3,28,29,30,31,32,33,34)
InChIKey	YVQWNADGSRXNKC-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_18000
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: D31595; Labnumber: VGU-18403; SBI_ID: SBI-018003
Synonyms	N-(4-methoxyphenyl)-N'-(6-{[(4-methylphenyl)sulfanyl]methyl}-4-oxo-1,4-dihydro-2-pyrimidinyl)-N''-[oxo(phenyl)methyl]guanidine
Temperature	318 °C