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2-(1,3-benzothiazol-2-ylsulfanyl)-N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]acetamide
SpectraBase Compound ID 1GXblHFe7vC
InChI InChI=1S/C25H18N6OS2/c1-15-18-9-2-3-10-19(18)24-29-28-23(31(24)30-15)16-7-6-8-17(13-16)26-22(32)14-33-25-27-20-11-4-5-12-21(20)34-25/h2-13H,14H2,1H3,(H,26,32)
InChIKey BKKYCTJVNZPQDV-UHFFFAOYSA-N
Mol Weight 482.58 g/mol
Molecular Formula C25H18N6OS2
Exact Mass 482.098352 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ChDfXxUZKzY
Name 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]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/C25H18N6OS2/c1-15-18-9-2-3-10-19(18)24-29-28-23(31(24)30-15)16-7-6-8-17(13-16)26-22(32)14-33-25-27-20-11-4-5-12-21(20)34-25/h2-13H,14H2,1H3,(H,26,32)
InChIKey BKKYCTJVNZPQDV-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10438
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: D79794; Labnumber: RRAZ-1476; SBI_ID: SBI-010441
Temperature 315 °C