2-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-cyclopentyl-ethanamide

Systemtic Name: 2-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[(2-bromo-4,5-diethoxy-phenyl)methylsulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[(2-bromo-4,5-diethoxyphenyl)methylthio]-N-cyclopentylacetamide IUPAC Name: 2-[(2-bromo-4,5-diethoxyphenyl)methylsulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[(2-bromo-4,5-diethoxy-benzyl)thio]-N-cyclopentyl-acetamide Formula: C18H26BrNO3S MolecularWeight: 416.37294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CSCC(=O)NC2CCCC2)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CSCC(=O)NC2CCCC2)Br)OCC

InChI

InChI=1S/C18H26BrNO3S/c1-3-22-16-9-13(15(19)10-17(16)23-4-2)11-24-12-18(21)20-14-7-5-6-8-14/h9-10,14H,3-8,11-12H2,1-2H3,(H,20,21)