N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-6-(2-furyl)-3-phenylisoxazolo[5,4-b]pyridine-4-carboxamide

SpectraBase Compound ID	BNKvgBfKOVd
InChI	InChI=1S/C25H16N4O3S/c26-13-17-15-8-4-10-20(15)33-25(17)28-23(30)16-12-18(19-9-5-11-31-19)27-24-21(16)22(29-32-24)14-6-2-1-3-7-14/h1-3,5-7,9,11-12H,4,8,10H2,(H,28,30)
InChIKey	WFDLOEOPNADQSX-UHFFFAOYSA-N Google Search
Mol Weight	452.49 g/mol
Molecular Formula	C25H16N4O3S
Exact Mass	452.094312 g/mol

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SpectraBase Spectrum ID	3wtj9eFxsDp
Name	N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-6-(2-furyl)-3-phenylisoxazolo[5,4-b]pyridine-4-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/C25H16N4O3S/c26-13-17-15-8-4-10-20(15)33-25(17)28-23(30)16-12-18(19-9-5-11-31-19)27-24-21(16)22(29-32-24)14-6-2-1-3-7-14/h1-3,5-7,9,11-12H,4,8,10H2,(H,28,30)
InChIKey	WFDLOEOPNADQSX-UHFFFAOYSA-N
NMR Offset	17.9121
NMR Spectrometer Frequency	500.077
Observed nucleus	1H
Origin	1H_SBI_36227_33613
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: 1996198; SBI_ID: SBI-033617
Temperature	303 °C