Isoquinoline, decahydro-2-benzyl-3-[3,3-bis(ethylthiocarbonyl)propyl]-

SpectraBase Compound ID	IS2k3rrr01Z
InChI	InChI=1S/C25H37NO2S2/c1-3-29-24(27)23(25(28)30-4-2)15-14-22-16-20-12-8-9-13-21(20)18-26(22)17-19-10-6-5-7-11-19/h5-7,10-11,20-23H,3-4,8-9,12-18H2,1-2H3
InChIKey	AQEMEDPEBLUDNF-UHFFFAOYSA-N Google Search
Mol Weight	447.7 g/mol
Molecular Formula	C25H37NO2S2
Exact Mass	447.226572 g/mol

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SpectraBase Spectrum ID	JJL4drxdH1o
Name
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C25H37NO2S2
InChI	InChI=1S/C25H37NO2S2/c1-3-29-24(27)23(25(28)30-4-2)15-14-22-16-20-12-8-9-13-21(20)18-26(22)17-19-10-6-5-7-11-19/h5-7,10-11,20-23H,3-4,8-9,12-18H2,1-2H3
InChIKey	AQEMEDPEBLUDNF-UHFFFAOYSA-N
Molecular Weight	447.2257
SMILES	C12CC(N(Cc3ccccc3)CC2CCCC1)CCC(C(SCC)=O)C(SCC)=O
SPLASH	splash10-004i-6190000000-ccf0c047d7abb3fd94ee
Source of Spectrum	Chemical Concepts, A Wiley Division, Weinheim, Germany