1-butyl-3,6-dimethyl-4-{[4-(2-thienylsulfonyl)-1-piperazinyl]carbonyl}-1H-pyrazolo[3,4-b]pyridine

SpectraBase Compound ID	511cvo8QlU1
InChI	InChI=1S/C21H27N5O3S2/c1-4-5-8-26-20-19(16(3)23-26)17(14-15(2)22-20)21(27)24-9-11-25(12-10-24)31(28,29)18-7-6-13-30-18/h6-7,13-14H,4-5,8-12H2,1-3H3
InChIKey	UAYXRHMOBBHQRB-UHFFFAOYSA-N Google Search
Mol Weight	461.6 g/mol
Molecular Formula	C21H27N5O3S2
Exact Mass	461.155532 g/mol

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SpectraBase Spectrum ID	4BOm3Q2JTXP
Name	1-butyl-3,6-dimethyl-4-{[4-(2-thienylsulfonyl)-1-piperazinyl]carbonyl}-1H-pyrazolo[3,4-b]pyridine
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/C21H27N5O3S2/c1-4-5-8-26-20-19(16(3)23-26)17(14-15(2)22-20)21(27)24-9-11-25(12-10-24)31(28,29)18-7-6-13-30-18/h6-7,13-14H,4-5,8-12H2,1-3H3
InChIKey	UAYXRHMOBBHQRB-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_33082
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: 1912012; SBI_ID: SBI-033086
Temperature	308 °C