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2-[(3-bromanyl-1-adamantyl)methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

2-[(3-bromanyl-1-adamantyl)methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name:2-[(3-bromanyl-1-adamantyl)methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide
Openeye Name:2-[(3-bromo-1-adamantyl)methylsulfanyl]-N-(2-ethyl-6-methyl-phenyl)acetamide
CAS Name:2-[(3-bromo-1-adamantyl)methylthio]-N-(2-ethyl-6-methylphenyl)acetamide
IUPAC Name:2-[(3-bromo-1-adamantyl)methylsulfanyl]-N-(2-ethyl-6-methylphenyl)acetamide
Traditional Name:2-[(3-bromo-1-adamantyl)methylthio]-N-(2-ethyl-6-methyl-phenyl)acetamide
Formula: C22H30BrNOS
MolecularWeight: 436.4487
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSCC23CC4CC(C2)CC(C4)(C3)Br)C


Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSCC23CC4CC(C2)CC(C4)(C3)Br)C


InChI

InChI=1S/C22H30BrNOS/c1-3-18-6-4-5-15(2)20(18)24-19(25)12-26-14-21-8-16-7-17(9-21)11-22(23,10-16)13-21/h4-6,16-17H,3,7-14H2,1-2H3,(H,24,25)


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