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6-chloro-2-{[2-oxo-2-(5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethyl]sulfanyl}-4-phenylquinazoline
SpectraBase Compound ID 4tNBEPBUc86
InChI InChI=1S/C25H19ClN4OS/c26-19-11-12-21-20(15-19)24(18-9-5-2-6-10-18)29-25(28-21)32-16-23(31)30-22(13-14-27-30)17-7-3-1-4-8-17/h1-12,14-15,22H,13,16H2
InChIKey LGHIJNKLBAFOHM-UHFFFAOYSA-N
Mol Weight 458.97 g/mol
Molecular Formula C25H19ClN4OS
Exact Mass 458.09681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 41EfaGNoHiq
Name 6-chloro-2-{[2-oxo-2-(5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethyl]sulfanyl}-4-phenylquinazoline
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/C25H19ClN4OS/c26-19-11-12-21-20(15-19)24(18-9-5-2-6-10-18)29-25(28-21)32-16-23(31)30-22(13-14-27-30)17-7-3-1-4-8-17/h1-12,14-15,22H,13,16H2
InChIKey LGHIJNKLBAFOHM-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9848
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: D60740; Labnumber: VGU-30226; SBI_ID: SBI-009851
Synonyms 6-chloro-4-phenyl-2-quinazolinyl 2-oxo-2-(5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethyl sulfide
Temperature 306 °C