2-(4-nitro-1H-pyrazol-1-yl)-N-[3-(1-piperidinylcarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]acetamide

SpectraBase Compound ID	GhM0arJvTDl
InChI	InChI=1S/C19H23N5O4S/c25-16(12-23-11-13(10-20-23)24(27)28)21-18-17(14-6-2-3-7-15(14)29-18)19(26)22-8-4-1-5-9-22/h10-11H,1-9,12H2,(H,21,25)
InChIKey	JCMFFOWMAOLWNP-UHFFFAOYSA-N Google Search
Mol Weight	417.48 g/mol
Molecular Formula	C19H23N5O4S
Exact Mass	417.147075 g/mol

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SpectraBase Spectrum ID	7wnBr08HSwa
Name	2-(4-nitro-1H-pyrazol-1-yl)-N-[3-(1-piperidinylcarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]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/C19H23N5O4S/c25-16(12-23-11-13(10-20-23)24(27)28)21-18-17(14-6-2-3-7-15(14)29-18)19(26)22-8-4-1-5-9-22/h10-11H,1-9,12H2,(H,21,25)
InChIKey	JCMFFOWMAOLWNP-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_11301
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/9086147; UBI_ID: UBI-011304
Temperature	308 °C