N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

SpectraBase Compound ID	32TWtmfojQB
InChI	InChI=1S/C26H24N4O3S/c1-17-6-9-21(10-7-17)30-25(19-5-3-4-18(2)14-19)28-29-26(30)34-16-24(31)27-20-8-11-22-23(15-20)33-13-12-32-22/h3-11,14-15H,12-13,16H2,1-2H3,(H,27,31)
InChIKey	LNTPAUFRRMSZKH-UHFFFAOYSA-N Google Search
Mol Weight	472.56 g/mol
Molecular Formula	C26H24N4O3S
Exact Mass	472.156912 g/mol

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SpectraBase Spectrum ID	CKIBOu4WQlA
Name	N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C26H24N4O3S/c1-17-6-9-21(10-7-17)30-25(19-5-3-4-18(2)14-19)28-29-26(30)34-16-24(31)27-20-8-11-22-23(15-20)33-13-12-32-22/h3-11,14-15H,12-13,16H2,1-2H3,(H,27,31)
InChIKey	LNTPAUFRRMSZKH-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11183
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: E06199; Labnumber: GRES-18110; SBI_ID: SBI-011186
Temperature	306 °C