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

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-butyl-ethanamide Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]-N-butyl-acetamide CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-N-butylacetamide IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]-N-butylacetamide Traditional Name: 2-[(2-bromo-4,5-dimethoxy-benzyl)thio]-N-butyl-acetamide Formula: C15H22BrNO3S MolecularWeight: 376.30908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSCC1=CC(=C(C=C1Br)OC)OC

Isomeric SMILES

CCCCNC(=O)CSCC1=CC(=C(C=C1Br)OC)OC

InChI

InChI=1S/C15H22BrNO3S/c1-4-5-6-17-15(18)10-21-9-11-7-13(19-2)14(20-3)8-12(11)16/h7-8H,4-6,9-10H2,1-3H3,(H,17,18)