2-(2-{4-[(2E)-3-(2-thienyl)-2-propenoyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione

SpectraBase Compound ID	1eiT7CL8INp
InChI	InChI=1S/C25H23N3O3S/c29-22(10-9-19-6-3-17-32-19)27-14-11-26(12-15-27)13-16-28-24(30)20-7-1-4-18-5-2-8-21(23(18)20)25(28)31/h1-10,17H,11-16H2/b10-9+
InChIKey	MQJWOTUIWICXNM-MDZDMXLPSA-N Google Search
Mol Weight	445.54 g/mol
Molecular Formula	C25H23N3O3S
Exact Mass	445.146013 g/mol

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SpectraBase Spectrum ID	FAqJlLzyXPS
Name	2-(2-{4-[(2E)-3-(2-thienyl)-2-propenoyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
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/C25H23N3O3S/c29-22(10-9-19-6-3-17-32-19)27-14-11-26(12-15-27)13-16-28-24(30)20-7-1-4-18-5-2-8-21(23(18)20)25(28)31/h1-10,17H,11-16H2/b10-9+
InChIKey	MQJWOTUIWICXNM-MDZDMXLPSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_2433
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: 111541; Labnumber: EX00111944; VK_ID: VK-002434
Synonyms	2-(2-{4-[3-(2-thienyl)-2-propenoyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Temperature	318 °C