3-[((E)-{4-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-3-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

SpectraBase Compound ID	1nU9NJpGGMv
InChI	InChI=1S/C23H19ClFN5O3S/c1-2-32-17-9-13(7-8-16(17)33-20-15(25)11-26-23(24)29-20)10-28-30-12-27-21-19(22(30)31)14-5-3-4-6-18(14)34-21/h7-12H,2-6H2,1H3/b28-10+
InChIKey	VTEFWOIVAHZVAZ-ORBVJSQLSA-N Google Search
Mol Weight	499.95 g/mol
Molecular Formula	C23H19ClFN5O3S
Exact Mass	499.088117 g/mol

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SpectraBase Spectrum ID	FRG4jqUWYZv
Name	3-[((E)-{4-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-3-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
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/C23H19ClFN5O3S/c1-2-32-17-9-13(7-8-16(17)33-20-15(25)11-26-23(24)29-20)10-28-30-12-27-21-19(22(30)31)14-5-3-4-6-18(14)34-21/h7-12H,2-6H2,1H3/b28-10+
InChIKey	VTEFWOIVAHZVAZ-ORBVJSQLSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4371
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: 120163; Labnumber: PFC-211912; VK_ID: VK-004372
Synonyms	3-[({4-[(2-chloro-5-fluoro-4-pyrimidinyl)oxy]-3-ethoxyphenyl}methylidene)amino]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Temperature	308 °C