4-allyl-3-[(2,4-dichlorobenzyl)sulfanyl]-5-(2-thienyl)-4H-1,2,4-triazole

SpectraBase Compound ID	IqMxOEqiNcd
InChI	InChI=1S/C16H13Cl2N3S2/c1-2-7-21-15(14-4-3-8-22-14)19-20-16(21)23-10-11-5-6-12(17)9-13(11)18/h2-6,8-9H,1,7,10H2
InChIKey	ZCNMJKKTWMWIQZ-UHFFFAOYSA-N Google Search
Mol Weight	382.33 g/mol
Molecular Formula	C16H13Cl2N3S2
Exact Mass	380.992795 g/mol

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SpectraBase Spectrum ID	EIOKxftcLJk
Name	4-allyl-3-[(2,4-dichlorobenzyl)sulfanyl]-5-(2-thienyl)-4H-1,2,4-triazole
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/C16H13Cl2N3S2/c1-2-7-21-15(14-4-3-8-22-14)19-20-16(21)23-10-11-5-6-12(17)9-13(11)18/h2-6,8-9H,1,7,10H2
InChIKey	ZCNMJKKTWMWIQZ-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13655
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: D89966; Labnumber: GRESKO-0971; SBI_ID: SBI-013658
Synonyms	4-allyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl 2,4-dichlorobenzyl sulfide
Temperature	308 °C