2-{[2-(4-chloro-3-methylphenoxy)propanoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

SpectraBase Compound ID	9jfO0f1ItXs
InChI	InChI=1S/C21H25ClN2O3S/c1-12-11-14(9-10-16(12)22)27-13(2)20(26)24-21-18(19(23)25)15-7-5-3-4-6-8-17(15)28-21/h9-11,13H,3-8H2,1-2H3,(H2,23,25)(H,24,26)
InChIKey	SQZNOIZOEFUARO-UHFFFAOYSA-N Google Search
Mol Weight	420.96 g/mol
Molecular Formula	C21H25ClN2O3S
Exact Mass	420.127442 g/mol

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SpectraBase Spectrum ID	Ib3J5cv1suA
Name	2-[2-(4-chloranyl-3-methyl-phenoxy)propanoylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H25ClN2O3S
InChI	InChI=1S/C21H25ClN2O3S/c1-12-11-14(9-10-16(12)22)27-13(2)20(26)24-21-18(19(23)25)15-7-5-3-4-6-8-17(15)28-21/h9-11,13H,3-8H2,1-2H3,(H2,23,25)(H,24,26)
InChIKey	SQZNOIZOEFUARO-UHFFFAOYSA-N
Molecular Weight	420.955 g/mol
SMILES	NC(c1c(sc2CCCCCCc12)NC(C(Oc1cc(C)c(cc1)Cl)C)=O)=O
SPLASH	splash10-001i-5980100000-44af182aa9eb221d9e05
Synonyms	2-[2-(4-chloro-3-methyl-phenoxy)propanoylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide 2-[[2-(4-chloro-3-methylphenoxy)-1-oxopropyl]amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Wiley ID	1447225