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2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide
SpectraBase Compound ID EVMfHEnAB1F
InChI InChI=1S/C19H18Cl2N4O2S/c1-2-25-17(11-27-16-8-6-13(20)7-9-16)23-24-19(25)28-12-18(26)22-15-5-3-4-14(21)10-15/h3-10H,2,11-12H2,1H3,(H,22,26)
InChIKey ULRBBZUNHMPYOE-UHFFFAOYSA-N
Mol Weight 437.35 g/mol
Molecular Formula C19H18Cl2N4O2S
Exact Mass 436.052752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CHcTPW9z7zs
Name 2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide
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/C19H18Cl2N4O2S/c1-2-25-17(11-27-16-8-6-13(20)7-9-16)23-24-19(25)28-12-18(26)22-15-5-3-4-14(21)10-15/h3-10H,2,11-12H2,1H3,(H,22,26)
InChIKey ULRBBZUNHMPYOE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11382
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: E06902; Labnumber: GRES-31304; SBI_ID: SBI-011385
Temperature 318 °C