2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-methyl-N-phenylacetamide IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-methyl-N-phenylacetamide Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-methyl-N-phenyl-acetamide Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CSCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CSCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C18H18BrNO3S/c1-20(14-5-3-2-4-6-14)18(21)12-24-11-13-9-16-17(10-15(13)19)23-8-7-22-16/h2-6,9-10H,7-8,11-12H2,1H3