(5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylene}-1-(2-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	BhtPrJr4ov
InChI	InChI=1S/C21H19N3O5/c25-19-16(12-22-11-15-6-7-17-18(10-15)29-13-28-17)20(26)24(21(27)23-19)9-8-14-4-2-1-3-5-14/h1-7,10,12,22H,8-9,11,13H2,(H,23,25,27)/b16-12+
InChIKey	FCEFSKURTWKMSA-FOWTUZBSSA-N Google Search
Mol Weight	393.4 g/mol
Molecular Formula	C21H19N3O5
Exact Mass	393.132471 g/mol

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SpectraBase Spectrum ID	AfpFAa6P0iT
Name	(5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylene}-1-(2-phenylethyl)-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/C21H19N3O5/c25-19-16(12-22-11-15-6-7-17-18(10-15)29-13-28-17)20(26)24(21(27)23-19)9-8-14-4-2-1-3-5-14/h1-7,10,12,22H,8-9,11,13H2,(H,23,25,27)/b16-12+
InChIKey	FCEFSKURTWKMSA-FOWTUZBSSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_8985
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: D40137; Labnumber: KKA-0211-1901; SBI_ID: SBI-008988
Synonyms	5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylene}-1-(2-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	306 °C