1-(1,3-benzodioxol-5-yl)-2-(isopentylsulfanyl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole 5,5-dioxide

SpectraBase Compound ID	8mNK0Xnovsx
InChI	InChI=1S/C17H22N2O4S2/c1-11(2)5-6-24-17-18-13-8-25(20,21)9-14(13)19(17)12-3-4-15-16(7-12)23-10-22-15/h3-4,7,11,13-14H,5-6,8-10H2,1-2H3
InChIKey	JWWJUSYNLMSTBM-UHFFFAOYSA-N Google Search
Mol Weight	382.49 g/mol
Molecular Formula	C17H22N2O4S2
Exact Mass	382.1021 g/mol

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SpectraBase Spectrum ID	AQ8TGAuA0zD
Name	1-(1,3-benzodioxol-5-yl)-2-(isopentylsulfanyl)-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole 5,5-dioxide
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/C17H22N2O4S2/c1-11(2)5-6-24-17-18-13-8-25(20,21)9-14(13)19(17)12-3-4-15-16(7-12)23-10-22-15/h3-4,7,11,13-14H,5-6,8-10H2,1-2H3
InChIKey	JWWJUSYNLMSTBM-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_35928
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: E97856; SBI_ID: SBI-035932
Synonyms	1-(1,3-benzodioxol-5-yl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl isopentyl sulfide
Temperature	308 °C