(5E)-1-(1,3-benzodioxol-5-yl)-5-{[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	CodCy0WYjR6
InChI	InChI=1S/C22H14ClN3O5/c23-13-3-5-14(6-4-13)25-9-1-2-15(25)10-17-20(27)24-22(29)26(21(17)28)16-7-8-18-19(11-16)31-12-30-18/h1-11H,12H2,(H,24,27,29)/b17-10+
InChIKey	QMDWAELFPZXJJX-LICLKQGHSA-N Google Search
Mol Weight	435.82 g/mol
Molecular Formula	C22H14ClN3O5
Exact Mass	435.062198 g/mol

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SpectraBase Spectrum ID	E7wncDrwnQm
Name	(5E)-1-(1,3-benzodioxol-5-yl)-5-{[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C22H14ClN3O5/c23-13-3-5-14(6-4-13)25-9-1-2-15(25)10-17-20(27)24-22(29)26(21(17)28)16-7-8-18-19(11-16)31-12-30-18/h1-11H,12H2,(H,24,27,29)/b17-10+
InChIKey	QMDWAELFPZXJJX-LICLKQGHSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_10057
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: 1001199; UBI_ID: UBI-010060
Synonyms	1-(1,3-benzodioxol-5-yl)-5-{[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	315 °C