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

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-ethyl-N-phenyl-ethanamide Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-ethyl-N-phenyl-acetamide CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-ethyl-N-phenylacetamide IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-ethyl-N-phenylacetamide Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-ethyl-N-phenyl-acetamide Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C18H18BrNO3S/c1-2-20(14-6-4-3-5-7-14)18(21)11-24-10-13-8-16-17(9-15(13)19)23-12-22-16/h3-9H,2,10-12H2,1H3