N~2~,N~5~-bis[3-(aminocarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl]-2,5-pyridinedicarboxamide

SpectraBase Compound ID	1zG5Nl2F69T
InChI	InChI=1S/C29H33N5O4S2/c30-24(35)22-17-9-5-1-3-7-11-20(17)39-28(22)33-26(37)16-13-14-19(32-15-16)27(38)34-29-23(25(31)36)18-10-6-2-4-8-12-21(18)40-29/h13-15H,1-12H2,(H2,30,35)(H2,31,36)(H,33,37)(H,34,38)
InChIKey	BVLAJROYHRMUEJ-UHFFFAOYSA-N Google Search
Mol Weight	579.7 g/mol
Molecular Formula	C29H33N5O4S2
Exact Mass	579.197397 g/mol

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SpectraBase Spectrum ID	8lb8jEWRcNr
Name	N~2~,N~5~-bis[3-(aminocarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl]-2,5-pyridinedicarboxamide
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/C29H33N5O4S2/c30-24(35)22-17-9-5-1-3-7-11-20(17)39-28(22)33-26(37)16-13-14-19(32-15-16)27(38)34-29-23(25(31)36)18-10-6-2-4-8-12-21(18)40-29/h13-15H,1-12H2,(H2,30,35)(H2,31,36)(H,33,37)(H,34,38)
InChIKey	BVLAJROYHRMUEJ-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_5026
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/8140756; UBI_ID: UBI-005028
Temperature	318 °C