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

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-N-cyclopentylacetamide IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[(2-bromo-4,5-dimethoxy-benzyl)thio]-N-cyclopentyl-acetamide Formula: C16H22BrNO3S MolecularWeight: 388.31978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CSCC(=O)NC2CCCC2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CSCC(=O)NC2CCCC2)Br)OC

InChI

InChI=1S/C16H22BrNO3S/c1-20-14-7-11(13(17)8-15(14)21-2)9-22-10-16(19)18-12-5-3-4-6-12/h7-8,12H,3-6,9-10H2,1-2H3,(H,18,19)