2-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

SpectraBase Compound ID	G8JYRTM29jg
InChI	InChI=1S/C20H21ClN4O3S/c21-12-9-23-25(10-12)11-13-7-8-15(28-13)19(27)24-20-17(18(22)26)14-5-3-1-2-4-6-16(14)29-20/h7-10H,1-6,11H2,(H2,22,26)(H,24,27)
InChIKey	IRLFXJDJJAICQT-UHFFFAOYSA-N Google Search
Mol Weight	432.93 g/mol
Molecular Formula	C20H21ClN4O3S
Exact Mass	432.102289 g/mol

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SpectraBase Spectrum ID	Fmo2vVSnT1Y
Name	2-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
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/C20H21ClN4O3S/c21-12-9-23-25(10-12)11-13-7-8-15(28-13)19(27)24-20-17(18(22)26)14-5-3-1-2-4-6-16(14)29-20/h7-10H,1-6,11H2,(H2,22,26)(H,24,27)
InChIKey	IRLFXJDJJAICQT-UHFFFAOYSA-N
NMR Offset	14.9921
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_4047
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: UZI/8113441; UBI_ID: UBI-004048
Temperature	308 °C