(2E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-{1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl}-2-propenamide

SpectraBase Compound ID	GR3XKybehJM
InChI	InChI=1S/C25H17ClN4O5S/c1-16-6-9-20(10-7-16)36(34,35)29-15-18(21-4-2-3-5-24(21)29)12-17(14-27)25(31)28-23-13-19(30(32)33)8-11-22(23)26/h2-13,15H,1H3,(H,28,31)/b17-12+
InChIKey	KZESFQZYNGPCAA-SFQUDFHCSA-N Google Search
Mol Weight	520.95 g/mol
Molecular Formula	C25H17ClN4O5S
Exact Mass	520.060819 g/mol

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SpectraBase Spectrum ID	673LMWOhtbB
Name	(2E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-{1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl}-2-propenamide
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/C25H17ClN4O5S/c1-16-6-9-20(10-7-16)36(34,35)29-15-18(21-4-2-3-5-24(21)29)12-17(14-27)25(31)28-23-13-19(30(32)33)8-11-22(23)26/h2-13,15H,1H3,(H,28,31)/b17-12+
InChIKey	KZESFQZYNGPCAA-SFQUDFHCSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_7903
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: 9686735; UBI_ID: UBI-007906
Synonyms	N-(2-chloro-5-nitrophenyl)-2-cyano-3-{1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl}-2-propenamide
Temperature	318 °C