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1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[[[5-(2-propenyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]methyl]-, ethyl

View entire compound with spectra: 2 NMR

1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[[[5-(2-propenyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]methyl]-, ethyl
SpectraBase Compound ID ARTSDiWPEO4
InChI InChI=1S/C20H18N10O3S/c1-3-9-29-12-8-6-5-7-11(12)14-17(29)22-20(25-23-14)34-10-13-15(19(31)32-4-2)24-28-30(13)18-16(21)26-33-27-18/h3,5-8H,1,4,9-10H2,2H3,(H2,21,26)
InChIKey KAGCAMUWMKBBDV-UHFFFAOYSA-N
Mol Weight 478.49 g/mol
Molecular Formula C20H18N10O3S
Exact Mass 478.128406 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LUCC8HzWPGS
Name 1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[[[5-(2-propenyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]methyl]-, ethyl
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.128405651 u
Formula C20H18N10O3S
InChI InChI=1S/C20H18N10O3S/c1-3-9-29-12-8-6-5-7-11(12)14-17(29)22-20(25-23-14)34-10-13-15(19(31)32-4-2)24-28-30(13)18-16(21)26-33-27-18/h3,5-8H,1,4,9-10H2,2H3,(H2,21,26)
InChIKey KAGCAMUWMKBBDV-UHFFFAOYSA-N
Molecular Weight 478.491 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_668
Solvent DMSO-d6
Source Vendor ID: ZI/8083773; Lab Info: VUR; Lab Number: VUR-0003395