6-amino-4-[4-(methylsulfanyl)phenyl]-3-(4-propoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

SpectraBase Compound ID	87xKdIGABEY
InChI	InChI=1S/C23H22N4O2S/c1-3-12-28-16-8-4-15(5-9-16)21-20-19(14-6-10-17(30-2)11-7-14)18(13-24)22(25)29-23(20)27-26-21/h4-11,19H,3,12,25H2,1-2H3,(H,26,27)
InChIKey	ZNKHKGFVHIMURB-UHFFFAOYSA-N Google Search
Mol Weight	418.52 g/mol
Molecular Formula	C23H22N4O2S
Exact Mass	418.146347 g/mol

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SpectraBase Spectrum ID	HKb9N70L8f4
Name	6-amino-4-[4-(methylsulfanyl)phenyl]-3-(4-propoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
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/C23H22N4O2S/c1-3-12-28-16-8-4-15(5-9-16)21-20-19(14-6-10-17(30-2)11-7-14)18(13-24)22(25)29-23(20)27-26-21/h4-11,19H,3,12,25H2,1-2H3,(H,26,27)
InChIKey	ZNKHKGFVHIMURB-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10925
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: E03371; Labnumber: MROZ-0278; SBI_ID: SBI-010928
Temperature	318 °C