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

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]acetamide CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]acetamide Traditional Name: N-benzyl-2-[(2-bromo-4,5-dimethoxy-benzyl)thio]acetamide Formula: C18H20BrNO3S MolecularWeight: 410.3253

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CSCC(=O)NCC2=CC=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CSCC(=O)NCC2=CC=CC=C2)Br)OC

InChI

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