5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	4qEBezspA9G
InChI	InChI=1S/C17H13Cl2N3O2S/c1-8-5-10(6-12-15(23)20-17(25)21-16(12)24)9(2)22(8)11-3-4-13(18)14(19)7-11/h3-7H,1-2H3,(H2,20,21,23,24,25)
InChIKey	LCYRVMXKUVWMCF-UHFFFAOYSA-N Google Search
Mol Weight	394.28 g/mol
Molecular Formula	C17H13Cl2N3O2S
Exact Mass	393.010553 g/mol

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SpectraBase Spectrum ID	BleaBV2tEE3
Name	5-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]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/C17H13Cl2N3O2S/c1-8-5-10(6-12-15(23)20-17(25)21-16(12)24)9(2)22(8)11-3-4-13(18)14(19)7-11/h3-7H,1-2H3,(H2,20,21,23,24,25)
InChIKey	LCYRVMXKUVWMCF-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_4817
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: 9677796; UBI_ID: UBI-004818
Temperature	318 °C