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N-(6-oxo-4-{[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]methyl}-1,6-dihydro-2-pyrimidinyl)-N'-phenylguanidine
SpectraBase Compound ID 8B7bnIsL7HT
InChI InChI=1S/C19H17N9OS/c20-17(21-13-7-3-1-4-8-13)24-18-22-14(11-16(29)23-18)12-30-19-25-26-27-28(19)15-9-5-2-6-10-15/h1-11H,12H2,(H4,20,21,22,23,24,29)
InChIKey REBKNJAARCSCLL-UHFFFAOYSA-N
Mol Weight 419.47 g/mol
Molecular Formula C19H17N9OS
Exact Mass 419.127677 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ayry8Xwm9jE
Name N-(6-oxo-4-{[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]methyl}-1,6-dihydro-2-pyrimidinyl)-N'-phenylguanidine
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/C19H17N9OS/c20-17(21-13-7-3-1-4-8-13)24-18-22-14(11-16(29)23-18)12-30-19-25-26-27-28(19)15-9-5-2-6-10-15/h1-11H,12H2,(H4,20,21,22,23,24,29)
InChIKey REBKNJAARCSCLL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29185
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: D91310; Labnumber: VGU-30759; SBI_ID: SBI-029189
Temperature 318 °C