3,5-bis({[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}amino)benzoic acid

SpectraBase Compound ID	C7Aa5mF4GUx
InChI	InChI=1S/C17H16N6O4S4/c1-8-20-22-16(30-8)28-6-13(24)18-11-3-10(15(26)27)4-12(5-11)19-14(25)7-29-17-23-21-9(2)31-17/h3-5H,6-7H2,1-2H3,(H,18,24)(H,19,25)(H,26,27)
InChIKey	UTPVTOWIQJXVIO-UHFFFAOYSA-N Google Search
Mol Weight	496.6 g/mol
Molecular Formula	C17H16N6O4S4
Exact Mass	496.011588 g/mol

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SpectraBase Spectrum ID	3YhLoQnNdbP
Name	3,5-bis({[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}amino)benzoic acid
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/C17H16N6O4S4/c1-8-20-22-16(30-8)28-6-13(24)18-11-3-10(15(26)27)4-12(5-11)19-14(25)7-29-17-23-21-9(2)31-17/h3-5H,6-7H2,1-2H3,(H,18,24)(H,19,25)(H,26,27)
InChIKey	UTPVTOWIQJXVIO-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_11471
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: 8157953; UBI_ID: UBI-011474
Temperature	318 °C