3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-6-(2,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

SpectraBase Compound ID	HgYFBXK9Jsg
InChI	InChI=1S/C18H18N6O3S/c1-25-12-8-14(27-3)13(26-2)7-10(12)17-23-24-16(21-22-18(24)28-17)15-9-5-4-6-11(9)19-20-15/h7-8H,4-6H2,1-3H3,(H,19,20)
InChIKey	JZALFYQVYSMHDD-UHFFFAOYSA-N Google Search
Mol Weight	398.44 g/mol
Molecular Formula	C18H18N6O3S
Exact Mass	398.11611 g/mol

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SpectraBase Spectrum ID	2xE3sMvGjn5
Name	3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-6-(2,4,5-trimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C18H18N6O3S/c1-25-12-8-14(27-3)13(26-2)7-10(12)17-23-24-16(21-22-18(24)28-17)15-9-5-4-6-11(9)19-20-15/h7-8H,4-6H2,1-3H3,(H,19,20)
InChIKey	JZALFYQVYSMHDD-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10540
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: E00594; Labnumber: GRES-16298; SBI_ID: SBI-010543
Temperature	318 °C