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1-(5-decan-5-ylsulfanylpentyl)azepane-2,7-dione

1-(5-decan-5-ylsulfanylpentyl)azepane-2,7-dione

Systemtic Name:1-(5-decan-5-ylsulfanylpentyl)azepane-2,7-dione
Openeye Name:1-[5-(1-butylhexylsulfanyl)pentyl]azepane-2,7-dione
CAS Name:1-[5-(decan-5-ylthio)pentyl]azepane-2,7-dione
IUPAC Name:1-(5-decan-5-ylsulfanylpentyl)azepane-2,7-dione
Traditional Name:1-[5-(1-butylhexylthio)pentyl]azepane-2,7-quinone
Formula: C21H39NO2S
MolecularWeight: 369.60486
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC)SCCCCCN1C(=O)CCCCC1=O


Isomeric SMILES

CCCCCC(CCCC)SCCCCCN1C(=O)CCCCC1=O


InChI

InChI=1S/C21H39NO2S/c1-3-5-8-14-19(13-6-4-2)25-18-12-7-11-17-22-20(23)15-9-10-16-21(22)24/h19H,3-18H2,1-2H3


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