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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID KMyOcRdiSUj
InChI InChI=1S/C19H15N9O4S/c1-33-14-8-2-11(3-9-14)10-21-23-19(29)15-16(12-4-6-13(7-5-12)28(30)31)27(26-22-15)18-17(20)24-32-25-18/h2-10H,1H3,(H2,20,24)(H,23,29)/b21-10+
InChIKey IHEXKFBTXRPLFY-UFFVCSGVSA-N
Mol Weight 465.45 g/mol
Molecular Formula C19H15N9O4S
Exact Mass 465.096771 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IkCFUtoAFlY
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
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/C19H15N9O4S/c1-33-14-8-2-11(3-9-14)10-21-23-19(29)15-16(12-4-6-13(7-5-12)28(30)31)27(26-22-15)18-17(20)24-32-25-18/h2-10H,1H3,(H2,20,24)(H,23,29)/b21-10+
InChIKey IHEXKFBTXRPLFY-UFFVCSGVSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23153
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: D37137; Labnumber: NIG1-2102; SBI_ID: SBI-023157
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[4-(methylsulfanyl)phenyl]methylidene}-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Temperature 306 °C