4-{[2-(3,4-dihydro-2(1H)-isoquinolinyl)-2-oxoethyl]sulfanyl}[1]benzofuro[3,2-d]pyrimidine

SpectraBase Compound ID	SuALLlkO63
InChI	InChI=1S/C21H17N3O2S/c25-18(24-10-9-14-5-1-2-6-15(14)11-24)12-27-21-20-19(22-13-23-21)16-7-3-4-8-17(16)26-20/h1-8,13H,9-12H2
InChIKey	YTLFMANJNYDQNH-UHFFFAOYSA-N Google Search
Mol Weight	375.45 g/mol
Molecular Formula	C21H17N3O2S
Exact Mass	375.104148 g/mol

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SpectraBase Spectrum ID	1R0vcdCi2O9
Name	4-{[2-(3,4-dihydro-2(1H)-isoquinolinyl)-2-oxoethyl]sulfanyl}[1]benzofuro[3,2-d]pyrimidine
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/C21H17N3O2S/c25-18(24-10-9-14-5-1-2-6-15(14)11-24)12-27-21-20-19(22-13-23-21)16-7-3-4-8-17(16)26-20/h1-8,13H,9-12H2
InChIKey	YTLFMANJNYDQNH-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10231
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: D68815; Labnumber: SC_0375-1062; SBI_ID: SBI-010234
Synonyms	[1]benzofuro[3,2-d]pyrimidin-4-yl 2-(3,4-dihydro-2(1H)-isoquinolinyl)-2-oxoethyl sulfide
Temperature	308 °C