2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-pentan-3-yl-ethanamide Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(1-ethylpropyl)acetamide CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-pentan-3-ylacetamide IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-pentan-3-ylacetamide Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-(1-ethylpropyl)acetamide Formula: C15H20BrNO3S MolecularWeight: 374.2932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSCC1=CC2=C(C=C1Br)OCO2

Isomeric SMILES

CCC(CC)NC(=O)CSCC1=CC2=C(C=C1Br)OCO2

InChI

InChI=1S/C15H20BrNO3S/c1-3-11(4-2)17-15(18)8-21-7-10-5-13-14(6-12(10)16)20-9-19-13/h5-6,11H,3-4,7-9H2,1-2H3,(H,17,18)