2-({5-[(3-chloroanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-2-pyridinyl)acetamide

SpectraBase Compound ID	2FLdPN2uEcS
InChI	InChI=1S/C23H21ClN6OS/c1-16-10-11-25-20(12-16)27-22(31)15-32-23-29-28-21(30(23)19-8-3-2-4-9-19)14-26-18-7-5-6-17(24)13-18/h2-13,26H,14-15H2,1H3,(H,25,27,31)
InChIKey	QLLLCFAYFWUPPJ-UHFFFAOYSA-N Google Search
Mol Weight	464.98 g/mol
Molecular Formula	C23H21ClN6OS
Exact Mass	464.118608 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	DU7n91g62Zs
Name	2-({5-[(3-chloroanilino)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-2-pyridinyl)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/C23H21ClN6OS/c1-16-10-11-25-20(12-16)27-22(31)15-32-23-29-28-21(30(23)19-8-3-2-4-9-19)14-26-18-7-5-6-17(24)13-18/h2-13,26H,14-15H2,1H3,(H,25,27,31)
InChIKey	QLLLCFAYFWUPPJ-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_3575
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/8093755; UBI_ID: UBI-003576
Temperature	308 °C