(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-2-propenenitrile

SpectraBase Compound ID	C8MsmvIuLm
InChI	InChI=1S/C21H17N3O3S/c1-25-17-4-2-3-14(9-17)18-13-28-21(24-18)15(11-22)12-23-16-5-6-19-20(10-16)27-8-7-26-19/h2-6,9-10,12-13,23H,7-8H2,1H3/b15-12+
InChIKey	WWPVDRRYWSJNIK-NTCAYCPXSA-N Google Search
Mol Weight	391.45 g/mol
Molecular Formula	C21H17N3O3S
Exact Mass	391.099063 g/mol

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SpectraBase Spectrum ID	7m3HLmjsPuC
Name	(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-2-propenenitrile
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/C21H17N3O3S/c1-25-17-4-2-3-14(9-17)18-13-28-21(24-18)15(11-22)12-23-16-5-6-19-20(10-16)27-8-7-26-19/h2-6,9-10,12-13,23H,7-8H2,1H3/b15-12+
InChIKey	WWPVDRRYWSJNIK-NTCAYCPXSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4549
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: 120581; Labnumber: ULGAP-18-0061; VK_ID: VK-004550
Synonyms	3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-2-propenenitrile
Temperature	318 °C