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2-hexylsulfanyl-N-(6-methylsulfanylisoquinolin-5-yl)decanamide

2-hexylsulfanyl-N-(6-methylsulfanylisoquinolin-5-yl)decanamide

Systemtic Name:2-hexylsulfanyl-N-(6-methylsulfanylisoquinolin-5-yl)decanamide
Openeye Name:2-hexylsulfanyl-N-(6-methylsulfanyl-5-isoquinolyl)decanamide
CAS Name:2-(hexylthio)-N-[6-(methylthio)-5-isoquinolinyl]decanamide
IUPAC Name:2-hexylsulfanyl-N-(6-methylsulfanylisoquinolin-5-yl)decanamide
Traditional Name:2-(hexylthio)-N-[6-(methylthio)-5-isoquinolyl]capramide
Formula: C26H40N2OS2
MolecularWeight: 460.7386
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)NC1=C(C=CC2=C1C=CN=C2)SC)SCCCCCC


Isomeric SMILES

CCCCCCCCC(C(=O)NC1=C(C=CC2=C1C=CN=C2)SC)SCCCCCC


InChI

InChI=1S/C26H40N2OS2/c1-4-6-8-10-11-12-14-24(31-19-13-9-7-5-2)26(29)28-25-22-17-18-27-20-21(22)15-16-23(25)30-3/h15-18,20,24H,4-14,19H2,1-3H3,(H,28,29)


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