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2-[(5-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)sulfanyl]-1-(4-methoxyphenyl)ethanone
SpectraBase Compound ID 5G5CXJoWi7L
InChI InChI=1S/C18H21N7O3S2/c1-4-19-14-21-15(20-5-2)23-16(22-14)30-18-25-24-17(28-18)29-10-13(26)11-6-8-12(27-3)9-7-11/h6-9H,4-5,10H2,1-3H3,(H2,19,20,21,22,23)
InChIKey CMNBHABQJQYKGP-UHFFFAOYSA-N
Mol Weight 447.53 g/mol
Molecular Formula C18H21N7O3S2
Exact Mass 447.11473 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5XA7ZIC6T6v
Name 2-[(5-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)sulfanyl]-1-(4-methoxyphenyl)ethanone
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/C18H21N7O3S2/c1-4-19-14-21-15(20-5-2)23-16(22-14)30-18-25-24-17(28-18)29-10-13(26)11-6-8-12(27-3)9-7-11/h6-9H,4-5,10H2,1-3H3,(H2,19,20,21,22,23)
InChIKey CMNBHABQJQYKGP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17567
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: 987/00005791; Labnumber: 987/00005791218871; VK_ID: VK-017572
Temperature 318 °C