2-({3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-4-oxo-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-phenylacetamide

SpectraBase Compound ID	145yiY5otiz
InChI	InChI=1S/C21H18ClN5O2S/c22-15-12-23-26(13-15)10-11-27-20(29)17-8-4-5-9-18(17)25-21(27)30-14-19(28)24-16-6-2-1-3-7-16/h1-9,12-13H,10-11,14H2,(H,24,28)
InChIKey	GEYBJEUITZCSFV-UHFFFAOYSA-N Google Search
Mol Weight	439.92 g/mol
Molecular Formula	C21H18ClN5O2S
Exact Mass	439.086974 g/mol

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SpectraBase Spectrum ID	DaeNE1yCSnn
Name	2-({3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-4-oxo-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-phenylacetamide
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/C21H18ClN5O2S/c22-15-12-23-26(13-15)10-11-27-20(29)17-8-4-5-9-18(17)25-21(27)30-14-19(28)24-16-6-2-1-3-7-16/h1-9,12-13H,10-11,14H2,(H,24,28)
InChIKey	GEYBJEUITZCSFV-UHFFFAOYSA-N
NMR Offset	17.9122
NMR Spectrometer Frequency	500.132
Observed nucleus	1H
Origin	1H_SBI_36227_30739
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: 1724744; SBI_ID: SBI-030743
Temperature	303 °C