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2-heptylsulfanyl-N-isoquinolin-5-yl-decanamide

2-heptylsulfanyl-N-isoquinolin-5-yl-decanamide

Systemtic Name:2-heptylsulfanyl-N-isoquinolin-5-yl-decanamide
Openeye Name:2-heptylsulfanyl-N-(5-isoquinolyl)decanamide
CAS Name:2-(heptylthio)-N-(5-isoquinolinyl)decanamide
IUPAC Name:2-heptylsulfanyl-N-isoquinolin-5-yldecanamide
Traditional Name:2-(heptylthio)-N-(5-isoquinolyl)capramide
Formula: C26H40N2OS
MolecularWeight: 428.6736
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)NC1=CC=CC2=C1C=CN=C2)SCCCCCCC


Isomeric SMILES

CCCCCCCCC(C(=O)NC1=CC=CC2=C1C=CN=C2)SCCCCCCC


InChI

InChI=1S/C26H40N2OS/c1-3-5-7-9-10-12-17-25(30-20-13-11-8-6-4-2)26(29)28-24-16-14-15-22-21-27-19-18-23(22)24/h14-16,18-19,21,25H,3-13,17,20H2,1-2H3,(H,28,29)


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