3-bromanyl-2,5-dimethoxy-N-[2-(phenylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 3-bromanyl-2,5-dimethoxy-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-3-bromo-2,5-dimethoxy-benzamide CAS Name: 3-bromo-2,5-dimethoxy-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-bromo-2,5-dimethoxybenzamide Traditional Name: N-[2-(benzylthio)ethyl]-3-bromo-2,5-dimethoxy-benzamide Formula: C18H20BrNO3S MolecularWeight: 410.3253

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)NCCSCC2=CC=CC=C2)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)NCCSCC2=CC=CC=C2)OC)Br

InChI

InChI=1S/C18H20BrNO3S/c1-22-14-10-15(17(23-2)16(19)11-14)18(21)20-8-9-24-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H,20,21)