(2Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-ylamino)-2-propenal

SpectraBase Compound ID	8y5eiUXlLxG
InChI	InChI=1S/C17H18ClN5O2/c18-13-1-2-15-14(3-13)20-16(25-15)12(5-24)4-19-17-6-21-9-22(7-17)11-23(8-17)10-21/h1-5,19H,6-11H2/b12-4+
InChIKey	DZRHXYDHBSEFHR-UUILKARUSA-N Google Search
Mol Weight	359.82 g/mol
Molecular Formula	C17H18ClN5O2
Exact Mass	359.114903 g/mol

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SpectraBase Spectrum ID	IAyvRpSyeeO
Name	(2Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-ylamino)-2-propenal
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/C17H18ClN5O2/c18-13-1-2-15-14(3-13)20-16(25-15)12(5-24)4-19-17-6-21-9-22(7-17)11-23(8-17)10-21/h1-5,19H,6-11H2/b12-4+
InChIKey	DZRHXYDHBSEFHR-UUILKARUSA-N
NMR Offset	14.9921
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_15923
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/8052505; UBI_ID: UBI-015926
Synonyms	2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-ylamino)-2-propenal
Temperature	313 °C